data_1eyf_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 1eyf _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 111.399 0.148 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.865 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.692 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.865 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.872 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.504 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.438 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.948 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.516 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.938 HG21 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.44 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 1.066 HG21 HG22 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.841 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.883 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.948 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.438 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 1.066 HG22 HG21 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.488 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.938 ' HB2' HG21 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.883 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.768 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.435 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.715 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.422 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.526 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.925 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.776 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.925 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.776 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.439 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.476 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.824 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.884 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.807 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.915 HG13 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.915 HG22 HG13 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.541 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.541 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.936 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.513 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.679 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.732 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.852 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.852 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.807 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HE2' HG23 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.906 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.936 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.493 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.606 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.906 ' HB2' ' HD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.632 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.432 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.751 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.905 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.812 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.905 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.812 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.542 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.411 ' HB2' ' NE ' ' A' ' 39' ' ' ARG . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.968 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.635 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.079 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.909 HG21 HG22 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.624 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.624 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.838 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.838 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.59 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.495 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.512 ' HB3' HG12 ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.422 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.909 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.55 ' HE2' HG23 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.079 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.557 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.623 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.557 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.673 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.776 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.59 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.754 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 10.8 m-20 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.877 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.73 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.877 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.97 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.727 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.727 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.48 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.674 ' CG2' HG22 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.722 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.722 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.654 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.97 ' HA ' HG21 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.442 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.495 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.415 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.513 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.513 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.871 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 1.077 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 1.077 ' HD2' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.565 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.663 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.816 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.663 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.816 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 17' ' ' LEU . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.514 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.934 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.428 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.104 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.774 HG21 HG22 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.646 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.84 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.84 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.882 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.557 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.934 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.514 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.887 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.887 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.439 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.774 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.104 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.521 ' HA ' HG11 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.882 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.688 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.532 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.688 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.855 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.467 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.431 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.498 ' HB2' HG21 ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.776 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.491 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.064 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.064 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.773 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.429 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.606 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.572 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.95 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.013 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.509 ' HD1' HG21 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.853 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.934 HG21 HG22 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.637 HG22 HG13 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.641 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.616 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.95 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.439 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.779 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.779 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.429 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.518 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.514 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.934 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.013 ' HB2' HG21 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.545 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.883 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.545 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.672 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.857 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.815 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.549 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.494 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.07 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.694 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.07 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.522 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.694 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.52 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.475 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.655 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.467 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.999 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.678 ' HE2' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.793 HG23 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.47 HG22 HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.453 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.471 ' CG2' ' HB2' ' A' ' 69' ' ' CYS . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.942 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.467 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.999 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.541 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.793 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.642 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.729 ' HA ' HG11 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.942 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.663 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.469 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.471 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.927 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.491 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.689 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.927 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.956 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.82 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.459 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.857 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.979 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.685 ' HD1' HG21 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.889 HG21 HG22 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.599 HG22 HG13 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.607 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.686 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.735 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.928 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.956 ' HA ' HG21 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.803 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.803 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.434 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.889 HG22 HG21 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.491 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG21 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.626 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.928 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.626 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.672 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.802 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.688 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.688 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.735 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.617 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 111.333 0.123 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.917 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.44 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.667 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.917 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.494 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.458 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.948 HG21 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.448 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 1.03 HG13 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 1.03 HG22 HG13 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.861 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.458 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.781 ' HA ' HG21 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.476 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.75 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.75 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.765 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.848 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.428 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG21 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.526 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.861 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.773 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.651 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.529 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.447 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.767 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.518 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.631 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.767 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.631 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.494 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.894 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.489 ' HD1' HG21 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.031 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.715 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.467 ' CG2' ' HB2' ' A' ' 69' ' ' CYS . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.9 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.894 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.495 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.495 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.507 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.656 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.518 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.031 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.503 ' HA ' HG11 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.9 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.68 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.881 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.47 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.622 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.637 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.912 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.756 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.531 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.411 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.949 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.778 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.008 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.475 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.783 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.989 HG13 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.989 HG22 HG13 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.566 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.807 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.857 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.949 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.76 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.473 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.522 ' HD2' HG13 ' A' ' 52' ' ' VAL . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.952 HG22 HG21 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HE1' ' NE ' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.008 ' HB2' HG21 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.583 ' HA ' HG11 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.792 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.434 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.667 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.807 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.421 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.568 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.435 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.76 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.49 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.954 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.524 ' CG ' ' HB2' ' A' ' 49' ' ' ARG . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.567 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.513 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.503 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.827 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.98 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.629 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.886 HG21 HG22 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.537 HG22 HG13 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.906 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.906 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.927 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.495 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.949 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.949 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.964 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.524 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.886 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.98 ' HB2' HG21 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG11 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.927 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.423 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.504 ' CG ' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.558 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.484 ' HB2' HG21 ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.964 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.664 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.949 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.518 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.828 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.949 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.711 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.518 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.914 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.023 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.644 ' HD1' HG21 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.748 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.972 HG21 HG22 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.573 HG22 HG13 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.599 ' H ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.936 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.914 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.853 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.853 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.439 ' HA ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.972 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.518 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.023 ' HB2' HG21 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.728 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.936 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.728 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.543 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.721 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.748 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.448 ' HB2' ' HG2' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.448 ' HG2' ' HB2' ' A' ' 68' ' ' PRO . 7.5 tp60 . . . . . 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.668 0.27 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.84 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.757 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.84 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.585 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.413 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.928 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.402 ' HB3' ' CD ' ' A' ' 39' ' ' ARG . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.01 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.647 ' HD2' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.752 HG21 HG22 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.496 HG23 ' N ' ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.496 ' N ' HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.868 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.649 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.928 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.413 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.628 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.587 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 51' ' ' ASN . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 48' ' ' LEU . 66.7 m-20 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.752 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.523 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.01 ' HB2' HG21 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.868 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.496 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.713 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.496 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.434 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.484 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.628 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.487 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.328 0.122 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.823 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.45 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.701 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.823 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.779 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.678 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.838 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.825 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.998 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.842 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.739 ' CG2' HG22 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.462 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.489 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.489 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.888 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.838 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.825 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.44 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.605 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.745 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.739 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.998 ' HB2' HG21 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.555 ' HA ' HG11 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.888 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.457 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.929 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.415 ' HG3' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.441 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.745 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.441 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 111.317 0.117 . . . . 0.0 111.317 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.531 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.827 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.8 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.524 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.627 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.627 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.649 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.981 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.455 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.044 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.672 HG11 HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.672 HG22 HG11 ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.788 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.788 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.859 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.826 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.826 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.429 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.589 ' HD2' ' H ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.517 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.827 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.531 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.044 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.489 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.859 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.489 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.638 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.415 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.857 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.514 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.475 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.464 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.492 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.504 0.192 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.008 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.533 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.673 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.732 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.679 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.684 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.805 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.608 ' O ' ' HD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.727 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.813 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.813 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.533 HG23 ' H ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.533 ' H ' HG23 ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.022 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.872 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.872 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.435 ' HB3' ' HD2' ' A' ' 39' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.753 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.533 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.805 ' HB2' HG21 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.722 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 1.022 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.722 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.531 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.727 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.496 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.496 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.753 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.761 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.451 0.167 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.643 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.556 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.68 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.643 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.739 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.89 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.575 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.015 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.589 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.046 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.656 HG23 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.667 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.635 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.87 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.492 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.89 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.423 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.529 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.637 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.656 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.589 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.046 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.559 ' C ' HG12 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.87 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.434 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.742 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.661 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.667 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.465 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.637 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.534 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.454 0.168 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.531 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.701 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.902 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.407 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.653 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.946 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.855 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.775 HG23 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.719 HG22 HG13 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.582 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.007 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.497 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.653 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.776 ' HA ' HG21 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.485 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.775 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.559 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.531 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.052 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.542 ' HA ' HG11 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.892 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.54 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 1.052 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.527 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.953 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.852 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.953 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.726 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.904 HG21 ' HA ' ' A' ' 40' ' ' PRO . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.576 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.681 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.953 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.402 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.924 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.982 HG21 HG22 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.852 HG22 HG13 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.59 HG23 ' H ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.59 ' H ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.956 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.576 ' HG2' ' CB ' ' A' ' 24' ' ' ASP . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.904 ' HA ' HG21 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.792 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.792 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.673 ' CB ' HG12 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.982 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.953 ' HB2' HG21 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.956 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.687 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.587 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.671 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.49 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.82 0.343 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.003 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.76 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.003 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 1.031 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.6 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.579 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.73 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.957 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.645 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.726 HG23 ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.68 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.68 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.969 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.579 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 1.031 ' HA ' HG21 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.485 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.818 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.818 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.726 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.663 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.957 ' HB2' HG21 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.628 ' HA ' HG11 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.969 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.428 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.442 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.834 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.691 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.616 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.469 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.458 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.526 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 120.455 0.169 . . . . 0.0 111.073 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.02 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.788 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.02 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.765 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 1.072 HG21 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.541 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.482 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.564 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.923 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.564 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.991 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.048 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.556 HG13 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.494 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.556 HG22 HG13 ' A' ' 31' ' ' VAL . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.532 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.839 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.488 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.923 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 1.072 ' HB3' HG21 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.482 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.724 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.5 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.526 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.575 HG12 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.529 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.048 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.839 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.431 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.577 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.624 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.905 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.469 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' HG21 ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.724 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.51 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.703 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.447 0.166 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.42 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.03 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.703 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.813 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.03 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.777 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.514 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.475 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.777 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.784 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.97 HG22 ' HD2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 1.039 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.748 HG21 HG22 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.464 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.464 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.98 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.98 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.475 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 46' ' ' HIS . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.897 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.897 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.68 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.42 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.813 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.608 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.752 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.463 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.46 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.697 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.066 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.819 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 1.066 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.819 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.525 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.706 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.958 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.512 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.756 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.822 HG21 HG22 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 32' ' ' ARG . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.586 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.641 ' H ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.809 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.644 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.706 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.884 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.884 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.589 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.532 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.822 HG22 HG21 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.958 ' HB2' HG21 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.766 ' HA ' HG11 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.809 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.428 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.655 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.57 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.756 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.744 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.618 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.44 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.805 0.336 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.526 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . 0.771 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.966 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.495 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.776 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.762 ' HD1' HG21 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.922 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.859 HG21 HG22 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.421 HG22 HG13 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.555 ' H ' HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.966 ' HA ' HG21 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.495 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.774 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.774 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.859 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.526 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG21 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.491 ' HA ' HG11 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.531 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.846 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.922 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.486 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.477 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.477 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtp . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 110.73 -0.1 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -92.17 76.03 5.37 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.56 170.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm 168.24 151.74 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.561 1.545 . . . . 0.0 110.506 -171.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.443 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . 172.87 47.65 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.58 1.552 . . . . 0.0 111.27 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 47.17 -96.13 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.83 1.652 . . . . 0.0 110.106 167.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.38 104.46 6.44 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.541 1.536 . . . . 0.0 110.385 -175.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.443 HD21 ' HB1' ' A' ' 4' ' ' ALA . 2.0 mm? -89.69 22.25 3.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.385 1.874 . . . . 0.0 110.938 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.3 p -53.56 148.12 9.96 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.287 1.835 . . . . 0.0 110.839 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -54.29 -21.67 9.88 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.58 1.552 . . . . 0.0 111.399 174.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.865 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.692 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.865 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.872 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.504 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.438 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.948 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.516 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.938 HG21 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.44 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 1.066 HG21 HG22 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.841 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.841 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.883 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.501 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.948 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.438 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.422 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 1.066 HG22 HG21 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.488 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.938 ' HB2' HG21 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.487 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.883 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.487 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.659 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.768 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.628 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.435 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.715 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.422 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.526 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -86.31 -57.02 0.35 Allowed Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.444 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 56.9 Cg_endo -79.28 -32.64 1.67 Allowed 'Trans proline' 0 CA--C 1.545 1.049 0 C-N-CA 124.677 3.584 . . . . 0.0 113.319 165.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 75.87 62.3 0.05 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.002 1.721 . . . . 0.0 111.073 -161.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -103.17 45.97 0.94 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.72 1.208 . . . . 0.0 110.242 -167.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.52 130.7 43.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.685 1.594 . . . . 0.0 111.273 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' N ' ' CD ' ' A' ' 79' ' ' PRO . 1.3 p-10 -126.67 34.95 0.27 Allowed Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.522 1.529 . . . . 0.0 111.241 -169.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 78' ' ' ASN . 86.5 Cg_endo -73.57 -88.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.251 3.301 . . . . 0.0 112.55 -166.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -23.19 -70.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 127.663 2.385 . . . . 0.0 112.368 169.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 82' ' ' HIS . 2.4 tt0 -15.97 123.28 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.526 2.73 . . . . 0.0 112.685 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 0.2 OUTLIER -28.52 134.47 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.122 1.769 . . . . 0.0 111.682 164.037 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.418 ' HA ' ' NE ' ' A' ' 83' ' ' ARG . 0.8 OUTLIER -97.35 56.01 1.31 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.571 1.148 . . . . 0.0 110.113 160.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.606 HD22 ' H ' ' A' ' 85' ' ' ASP . 0.1 OUTLIER -42.43 154.29 0.06 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.371 2.269 . . . . 0.0 111.561 -174.52 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.606 ' H ' HD22 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -39.86 -81.76 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.603 1.961 . . . . 0.0 111.693 -164.853 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 167.04 -48.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.414 1.886 . . . . 0.0 110.347 164.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.2 mt -53.25 137.55 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 125.619 1.567 . . . . 0.0 108.98 -165.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.3 t -77.22 163.31 26.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.582 1.553 . . . . 0.0 110.068 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 59.44 93.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.591 1.556 . . . . 0.0 111.38 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -137.54 77.61 1.64 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.632 1.573 . . . . 0.0 110.731 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.42 -42.78 22.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.552 1.541 . . . . 0.0 110.384 -175.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 110.161 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 120.382 0.134 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.67 12.04 8.66 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.663 1.585 . . . . 0.0 110.714 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt 41.27 67.21 0.56 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.501 1.52 . . . . 0.0 110.454 -167.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 170.94 -56.19 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.838 1.655 . . . . 0.0 111.102 -175.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 m 89.54 -84.45 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.039 1.735 . . . . 0.0 110.267 163.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 m -102.29 48.19 0.88 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.408 1.483 . . . . 0.0 110.665 -163.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.37 23.91 2.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.3 1.84 . . . . 0.0 111.065 168.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.3 157.68 30.6 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.702 2.001 . . . . 0.0 110.769 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -72.01 -33.85 68.4 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.421 1.488 . . . . 0.0 111.413 -170.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.925 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.776 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.925 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.776 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.439 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.476 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.824 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.884 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.807 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.632 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.915 HG13 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.915 HG22 HG13 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.541 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.541 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.936 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.513 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.679 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.732 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.852 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.852 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.807 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HE2' HG23 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.906 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG11 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.936 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.493 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.606 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.906 ' HB2' ' HD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.446 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.606 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.632 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.432 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.751 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -49.91 -54.48 32.04 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.6 Cg_endo -92.4 -98.97 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 124.911 3.741 . . . . 0.0 113.123 169.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.3 49.58 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.476 1.911 . . . . 0.0 110.667 169.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -90.78 37.65 0.93 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.182 1.393 . . . . 0.0 110.739 -161.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.14 152.08 11.27 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.468 1.507 . . . . 0.0 111.206 166.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -145.2 56.31 3.54 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.641 1.576 . . . . 0.0 111.013 -172.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.3 110.94 2.14 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.361 3.374 . . . . 0.0 112.532 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -20.93 -71.21 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.829 2.452 . . . . 0.0 112.39 171.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 59.21 -177.07 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.77 1.628 . . . . 0.0 110.981 175.12 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.511 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 20.4 t60 -98.02 17.9 17.29 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.558 1.543 . . . . 0.0 111.393 -171.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 48.39 91.73 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.578 1.551 . . . . 0.0 111.157 -170.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 179.5 108.3 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.502 1.921 . . . . 0.0 111.954 -171.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -148.44 -145.3 0.17 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.571 1.548 . . . . 0.0 111.162 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.3 mttm 64.48 -172.67 0.18 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.598 1.559 . . . . 0.0 110.535 167.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.2 tp -124.49 52.93 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.13 1.772 . . . . 0.0 108.956 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.8 p -61.19 171.22 1.39 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.677 1.591 . . . . 0.0 110.037 173.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -63.34 134.04 55.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.613 1.565 . . . . 0.0 111.428 172.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 62.63 -174.21 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.545 1.538 . . . . 0.0 110.759 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.7 m -138.67 40.89 2.19 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.597 1.559 . . . . 0.0 110.36 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.47 0.557 0 C-N-CA 125.621 1.568 . . . . 0.0 110.122 -169.454 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.701 -0.111 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -130.87 27.71 4.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 110.472 172.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.8 mttp -148.02 -169.01 3.23 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.575 1.55 . . . . 0.0 110.502 -169.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 177.65 -156.19 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.562 1.545 . . . . 0.0 111.241 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.7 p -50.18 160.87 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.587 1.555 . . . . 0.0 110.058 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 m -100.51 62.79 1.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.606 1.562 . . . . 0.0 110.387 -172.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.59 19.62 4.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.38 1.872 . . . . 0.0 110.927 172.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 m -58.56 164.85 2.43 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.244 1.818 . . . . 0.0 110.815 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 -66.1 -28.18 68.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.459 1.503 . . . . 0.0 111.337 -172.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.905 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.812 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.905 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.812 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.542 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.411 ' HB2' ' NE ' ' A' ' 39' ' ' ARG . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.968 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.635 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.079 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.909 HG21 HG22 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.624 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.624 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.754 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.838 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.838 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.59 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.495 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.495 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.512 ' HB3' HG12 ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.422 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.909 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.55 ' HE2' HG23 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.079 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.557 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.623 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.557 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.673 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.776 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.59 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.454 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.754 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.61 -54.51 0.42 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.443 ' HD3' ' HB2' ' A' ' 68' ' ' PRO . 69.1 Cg_endo -78.64 -22.67 8.98 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.487 3.458 . . . . 0.0 112.729 167.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 68.2 55.75 0.53 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.776 1.63 . . . . 0.0 111.13 -164.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.414 ' HB2' ' HG2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -105.01 36.38 2.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.522 1.129 . . . . 0.0 110.095 -163.11 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.0 168.17 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.667 1.587 . . . . 0.0 111.254 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.417 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -154.33 178.43 1.63 Allowed Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.703 1.601 . . . . 0.0 110.899 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.417 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 83.5 Cg_exo -46.72 104.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.277 3.318 . . . . 0.0 112.424 164.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.477 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -38.4 -162.24 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 129.824 3.25 . . . . 0.0 116.897 172.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.477 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 3.2 tp60 5.15 84.5 0.01 OUTLIER 'General case' 0 C--N 1.363 1.167 0 C-N-CA 128.805 2.842 . . . . 0.0 112.589 -165.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.67 -26.23 5.76 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.604 1.562 . . . . 0.0 111.578 167.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 29.71 55.58 0.15 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.893 1.677 . . . . 0.0 110.761 -160.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.402 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -38.39 109.78 0.11 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.049 2.14 . . . . 0.0 111.89 -167.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.402 ' N ' HD22 ' A' ' 84' ' ' LEU . 3.4 p30 -93.67 164.51 13.12 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.147 1.779 . . . . 0.0 111.422 -170.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 84.17 121.34 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.647 1.579 . . . . 0.0 110.701 163.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm 49.39 81.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.94 1.696 . . . . 0.0 109.003 164.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -61.87 -39.85 93.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.609 1.563 . . . . 0.0 110.074 -172.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -149.85 -83.08 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.585 1.554 . . . . 0.0 111.437 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -119.91 -84.14 0.66 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.594 1.558 . . . . 0.0 110.735 173.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 169.44 135.18 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.591 1.556 . . . . 0.0 110.406 -176.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 125.6 1.56 . . . . 0.0 110.138 176.497 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 110.696 -0.113 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 65.52 63.37 0.63 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.538 1.535 . . . . 0.0 110.561 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -133.97 11.58 3.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.487 1.515 . . . . 0.0 111.004 -178.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.49 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.401 1.48 . . . . 0.0 111.292 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.8 t 30.97 49.94 0.09 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.467 1.907 . . . . 0.0 110.403 -166.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.97 -161.21 1.12 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.625 1.57 . . . . 0.0 110.391 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.413 HD12 ' CZ ' ' A' ' 12' ' ' ARG . 2.2 mm? -89.43 23.3 2.6 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.382 1.873 . . . . 0.0 110.897 165.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.0 m -59.68 168.43 1.68 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.452 1.901 . . . . 0.0 110.819 175.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 10.8 m-20 -62.33 -23.93 67.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.671 1.589 . . . . 0.0 111.42 -174.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.877 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.73 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.877 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.97 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.727 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.727 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.48 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.674 ' CG2' HG22 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.403 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.722 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.722 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.882 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.654 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.97 ' HA ' HG21 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.442 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.495 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.415 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.464 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.513 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.882 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.513 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.513 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.871 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 1.077 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 1.077 ' HD2' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.565 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -57.49 -50.88 85.63 Favored Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.443 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 94.7 Cg_endo -94.96 -96.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 125.067 3.845 . . . . 0.0 112.899 170.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 171.95 67.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.066 2.147 . . . . 0.0 110.473 162.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -104.24 27.95 7.29 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.057 1.343 . . . . 0.0 110.4 -161.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.08 129.04 9.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.57 1.548 . . . . 0.0 111.271 168.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -125.66 80.91 65.81 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.631 1.572 . . . . 0.0 110.961 175.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -63.28 119.15 6.1 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 124.242 3.295 . . . . 0.0 112.461 164.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -21.96 -67.71 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.321 2.648 . . . . 0.0 112.732 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -19.27 131.88 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.813 2.445 . . . . 0.0 112.312 169.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -47.41 -30.46 3.33 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.459 1.504 . . . . 0.0 111.384 165.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 40.0 65.43 0.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.731 1.612 . . . . 0.0 111.134 -177.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.52 130.07 0.08 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.534 1.934 . . . . 0.0 111.951 -174.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.94 -73.96 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.547 1.539 . . . . 0.0 111.144 169.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 165.03 -52.87 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 110.25 176.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER 35.42 86.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 127.46 2.304 . . . . 0.0 109.49 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.9 p -50.86 -25.74 4.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.551 1.54 . . . . 0.0 110.08 -173.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -60.76 138.68 58.08 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.584 1.553 . . . . 0.0 111.448 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.94 27.11 0.62 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 110.683 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.9 m 39.1 35.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.572 1.549 . . . . 0.0 110.381 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.606 1.563 . . . . 0.0 110.136 178.414 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 33.02 84.03 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.648 1.979 . . . . 0.0 110.461 -170.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 75.55 136.8 0.06 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.711 1.604 . . . . 0.0 110.495 167.418 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 170.94 120.05 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.473 1.509 . . . . 0.0 111.413 176.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.727 ' HB ' HD23 ' A' ' 7' ' ' LEU . 6.1 p 51.31 90.57 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.197 1.799 . . . . 0.0 110.235 164.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.99 83.65 0.12 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.701 1.6 . . . . 0.0 110.477 165.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.727 HD23 ' HB ' ' A' ' 5' ' ' THR . 0.3 OUTLIER -89.84 19.79 4.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.449 1.9 . . . . 0.0 110.876 -171.709 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -50.5 145.19 6.79 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.332 1.853 . . . . 0.0 110.942 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 -58.86 -18.41 32.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.711 1.604 . . . . 0.0 111.382 175.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.663 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.816 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.663 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.816 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 17' ' ' LEU . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.514 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.934 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.104 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.774 HG21 HG22 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.646 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.84 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.84 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.882 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.557 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.934 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.514 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.887 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.887 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.439 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.774 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.104 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.521 ' HA ' HG11 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.882 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.688 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.532 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.427 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.688 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.855 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.467 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.431 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.498 ' HB2' HG21 ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.776 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.491 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -51.1 -48.99 83.77 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.412 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 62.9 Cg_endo -81.75 -33.9 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.936 3.758 . . . . 0.0 113.379 165.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.8 t0 78.28 55.72 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.445 1.898 . . . . 0.0 111.032 -163.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.423 ' HG3' ' N ' ' A' ' 77' ' ' ALA . 6.3 tppt? -110.91 158.78 18.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.401 1.48 . . . . 0.0 110.222 -164.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.423 ' N ' ' HG3' ' A' ' 76' ' ' LYS . . . -79.73 171.85 14.58 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.597 1.559 . . . . 0.0 111.251 173.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.31 103.57 22.7 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.598 1.559 . . . . 0.0 110.987 172.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.36 -93.66 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 124.209 3.273 . . . . 0.0 112.378 -172.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -18.79 -97.53 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 128.577 2.751 . . . . 0.0 113.136 -173.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -19.79 122.03 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.658 2.383 . . . . 0.0 112.114 166.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.4 p80 -155.17 128.88 8.58 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.225 1.41 . . . . 0.0 111.848 -178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -113.86 51.68 0.85 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.059 1.344 . . . . 0.0 110.186 160.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.624 HD23 ' N ' ' A' ' 85' ' ' ASP . 5.5 tt -41.63 145.74 0.28 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.994 2.117 . . . . 0.0 111.676 -162.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.624 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.1 t0 -121.66 -53.11 2.0 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.386 1.474 . . . . 0.0 111.278 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 tptt 78.69 138.86 0.07 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.53 1.532 . . . . 0.0 110.5 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 pt -146.48 79.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.569 1.548 . . . . 0.0 108.938 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.433 HG21 ' CD2' ' A' ' 89' ' ' HIS . 6.0 t -67.77 139.87 56.65 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.631 1.572 . . . . 0.0 110.107 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' CD2' HG21 ' A' ' 88' ' ' THR . 39.2 m-70 75.19 67.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.628 1.571 . . . . 0.0 111.453 -172.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -44.56 103.99 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.618 1.567 . . . . 0.0 110.696 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.2 m -78.01 103.46 7.97 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.633 1.573 . . . . 0.0 110.368 -170.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.601 1.56 . . . . 0.0 110.134 176.61 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.2 mtt . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.707 -0.109 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.39 34.71 5.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.595 1.558 . . . . 0.0 110.526 175.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 16.7 mmtp -60.95 -88.07 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.647 1.579 . . . . 0.0 110.495 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 160.34 35.62 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.579 1.552 . . . . 0.0 111.236 -166.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -68.04 0.08 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.592 1.557 . . . . 0.0 110.083 -166.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 57.04 97.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.584 1.553 . . . . 0.0 110.394 -177.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -89.69 21.73 3.37 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.352 1.861 . . . . 0.0 110.852 -170.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.0 p -50.7 130.77 25.14 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.134 1.774 . . . . 0.0 110.763 175.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.0 -24.17 57.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 0.0 111.326 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.064 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.557 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.064 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.773 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.429 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.439 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.606 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.572 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.95 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.013 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.509 ' HD1' HG21 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.853 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.934 HG21 HG22 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.637 HG22 HG13 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.641 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.616 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.95 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.439 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.779 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.779 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.429 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.518 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.514 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.934 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.557 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.013 ' HB2' HG21 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.545 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.883 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.545 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.672 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.857 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.815 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.549 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HG3' ' HB2' ' A' ' 76' ' ' LYS . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.494 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -72.77 125.46 91.17 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -33.34 91.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.076 1 C-N-CA 125.451 4.1 . . . . 0.0 113.768 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -148.6 -70.05 0.22 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.059 1.744 . . . . 0.0 111.156 -172.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -114.86 77.24 1.05 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.141 1.376 . . . . 0.0 110.021 165.854 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.29 175.48 8.31 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.156 1.782 . . . . 0.0 111.266 164.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.429 ' HA ' ' HD3' ' A' ' 79' ' ' PRO . 0.0 OUTLIER -34.08 135.09 0.36 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 126.829 2.052 . . . . 0.0 111.543 178.121 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 78' ' ' ASN . 32.5 Cg_exo -62.41 113.56 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.748 3.632 . . . . 0.0 112.445 -166.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -21.41 -72.5 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.602 2.361 . . . . 0.0 112.345 168.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 64.31 47.82 3.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.006 1.723 . . . . 0.0 111.13 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 46.48 95.76 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.478 1.911 . . . . 0.0 111.819 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -83.83 55.15 3.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.258 1.023 . . . . 0.0 110.393 161.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.416 ' C ' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -39.71 114.97 0.47 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.029 2.132 . . . . 0.0 111.609 -170.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.26 -81.56 0.63 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.609 1.564 . . . . 0.0 111.25 -177.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt 157.16 -179.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.138 1.775 . . . . 0.0 110.44 -164.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.4 mt 64.54 85.52 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.558 1.543 . . . . 0.0 108.978 -165.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.3 p -82.95 100.48 10.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.573 1.549 . . . . 0.0 110.092 -164.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.5 m170 50.04 33.18 6.53 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.623 1.569 . . . . 0.0 111.457 165.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.83 -175.65 5.54 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.585 1.554 . . . . 0.0 110.744 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 28.7 m -117.04 -28.77 6.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.678 1.591 . . . . 0.0 110.382 171.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 125.634 1.574 . . . . 0.0 110.17 170.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtp . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.738 -0.097 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -129.23 133.29 47.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.614 1.566 . . . . 0.0 110.497 -174.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -102.67 -170.61 1.83 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.566 1.546 . . . . 0.0 110.466 167.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.03 92.92 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.614 1.566 . . . . 0.0 111.249 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.72 140.25 37.86 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.554 1.542 . . . . 0.0 110.055 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.834 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.7 OUTLIER -94.28 166.85 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.552 1.541 . . . . 0.0 110.307 166.435 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -89.67 20.52 3.98 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.386 1.874 . . . . 0.0 110.847 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.834 HG23 ' HB3' ' A' ' 6' ' ' CYS . 49.7 p -51.68 134.04 30.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.092 1.757 . . . . 0.0 110.851 -177.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 -59.15 -17.92 31.37 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.413 1.485 . . . . 0.0 111.388 -173.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.07 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.476 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.694 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.07 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.522 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.694 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.52 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.475 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.655 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.467 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.999 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.936 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.678 ' HE2' HG11 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.799 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.793 HG23 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.47 HG22 HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.453 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.471 ' CG2' ' HB2' ' A' ' 69' ' ' CYS . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.942 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.527 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.467 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.999 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.541 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.793 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.642 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.936 ' HB2' HG21 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.729 ' HA ' HG11 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.942 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.725 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.663 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.725 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.469 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.799 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.471 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -75.8 107.38 4.21 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -32.58 88.21 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.239 4.626 . . . . 0.0 114.307 -163.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.41 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 42.1 t0 -129.86 -62.63 0.95 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.394 1.878 . . . . 0.0 111.098 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.2 tppt? -135.65 131.76 36.17 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.044 1.338 . . . . 0.0 110.383 163.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.93 170.18 12.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.637 1.575 . . . . 0.0 111.264 166.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -61.41 120.57 56.66 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.729 1.612 . . . . 0.0 111.007 -176.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -72.59 150.01 50.37 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.372 3.381 . . . . 0.0 112.724 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.406 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 8.0 ttm180 24.72 -106.63 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.312 2.245 . . . . 0.0 112.139 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.406 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 4.8 tt0 66.26 85.3 0.14 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.908 1.683 . . . . 0.0 110.974 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.51 -43.98 1.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.611 1.564 . . . . 0.0 111.365 164.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.0 mtm-85 37.65 76.17 0.06 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.651 1.58 . . . . 0.0 111.087 -169.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 tt 179.51 114.63 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.521 1.928 . . . . 0.0 111.939 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.02 -52.33 36.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.665 1.586 . . . . 0.0 111.212 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 166.48 126.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.039 1.736 . . . . 0.0 110.452 -169.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.9 tt -65.52 131.44 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.624 1.57 . . . . 0.0 108.965 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.0 p -84.73 173.06 10.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.596 1.559 . . . . 0.0 110.048 -175.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 78.4 m80 60.34 30.28 19.69 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.625 1.57 . . . . 0.0 111.43 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -88.56 -169.71 2.65 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.591 1.556 . . . . 0.0 110.676 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 t -95.23 -45.95 6.96 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.578 1.551 . . . . 0.0 110.337 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.579 1.552 . . . . 0.0 110.166 171.642 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 110.703 -0.11 . . . . 0.0 110.703 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -128.66 172.47 11.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.57 1.548 . . . . 0.0 110.503 -172.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -71.37 151.39 44.14 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.612 1.565 . . . . 0.0 110.5 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 71.39 152.44 0.11 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.6 1.56 . . . . 0.0 111.249 170.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 168.49 136.4 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.583 1.553 . . . . 0.0 110.057 -172.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t 76.59 48.03 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.601 1.56 . . . . 0.0 110.37 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.794 HD12 HH21 ' A' ' 12' ' ' ARG . 2.0 mm? -89.67 18.99 4.94 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.449 1.899 . . . . 0.0 110.901 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 53.2 p -48.65 151.98 1.06 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.23 1.812 . . . . 0.0 110.848 -173.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 -57.42 -16.92 10.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.523 1.529 . . . . 0.0 111.349 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.927 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.794 HH21 HD12 ' A' ' 7' ' ' LEU . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.689 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.927 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.956 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.82 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.459 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.857 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.979 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.685 ' HD1' HG21 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.889 HG21 HG22 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.599 HG22 HG13 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.607 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.686 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.735 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.928 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.956 ' HA ' HG21 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.803 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.803 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.584 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.434 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.889 HG22 HG21 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.491 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG21 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.626 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.928 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.626 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.672 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.802 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.672 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.688 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.688 ' CD2' ' HB3' ' A' ' 64' ' ' ALA . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.735 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.617 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -72.53 -52.11 6.77 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.459 ' CG ' ' HG3' ' A' ' 76' ' ' LYS . 54.7 Cg_endo -87.43 -29.17 0.39 Allowed 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.592 3.528 . . . . 0.0 113.631 172.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.76 56.1 0.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.716 1.606 . . . . 0.0 111.052 -162.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.459 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -100.28 26.91 6.08 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.221 1.409 . . . . 0.0 110.569 -162.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.16 84.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.539 1.535 . . . . 0.0 111.351 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 t30 162.21 93.82 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 110.917 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 -107.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.13 3.22 . . . . 0.0 112.248 -166.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -30.09 -72.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.601 2.36 . . . . 0.0 112.799 -162.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -27.55 143.67 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.609 2.364 . . . . 0.0 112.356 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -107.79 -46.14 3.86 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.217 1.407 . . . . 0.0 111.706 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 21.68 59.87 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.778 2.031 . . . . 0.0 111.211 -160.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.926 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.5 OUTLIER -34.33 140.9 0.06 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.351 2.26 . . . . 0.0 111.731 -177.277 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.926 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -121.63 147.08 46.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.502 1.521 . . . . 0.0 111.285 172.507 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.31 -76.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.694 1.998 . . . . 0.0 110.294 -171.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.8 mm 65.03 97.12 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.616 1.566 . . . . 0.0 108.997 -177.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 t -61.05 154.49 22.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.584 1.554 . . . . 0.0 110.085 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -61.82 116.64 5.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.566 1.546 . . . . 0.0 111.44 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.93 71.5 0.47 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.61 1.564 . . . . 0.0 110.731 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -50.6 7.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.626 1.57 . . . . 0.0 110.358 -174.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.589 1.555 . . . . 0.0 110.155 -173.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mtp . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -126.27 63.08 1.26 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.581 1.552 . . . . 0.0 110.512 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.3 OUTLIER -77.66 -42.41 34.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.601 1.56 . . . . 0.0 110.532 179.151 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 81.12 120.06 0.05 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.631 1.572 . . . . 0.0 111.26 172.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -127.61 101.7 6.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.015 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 8' ' ' THR . 6.7 t 78.12 140.06 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.621 1.569 . . . . 0.0 110.402 175.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.478 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.65 19.14 4.83 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.385 1.874 . . . . 0.0 110.914 -170.218 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.543 HG23 ' SG ' ' A' ' 6' ' ' CYS . 31.3 p -45.59 128.69 8.5 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.173 1.789 . . . . 0.0 110.809 -174.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 -64.35 -18.22 64.44 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.455 1.502 . . . . 0.0 111.333 -169.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.917 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.478 ' NH1' HD13 ' A' ' 7' ' ' LEU . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.667 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.917 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.781 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.491 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.476 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.494 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.458 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.508 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.948 HG21 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.497 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.448 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 1.03 HG13 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 1.03 HG22 HG13 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.861 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.458 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.781 ' HA ' HG21 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.476 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.75 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.75 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.765 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.848 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.428 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG21 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.526 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.861 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.651 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.773 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.651 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.529 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.409 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.447 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.47 -53.18 0.46 Allowed Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.472 ' HG2' ' CE ' ' A' ' 76' ' ' LYS . 4.1 Cg_endo -79.95 -26.66 4.31 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 125.009 3.806 . . . . 0.0 112.897 168.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.6 t0 65.51 56.57 0.94 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.58 1.552 . . . . 0.0 111.182 -163.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' CE ' ' HG2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -107.4 40.97 1.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.856 1.262 . . . . 0.0 110.434 -163.218 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.51 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -66.67 96.5 0.4 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.508 1.523 . . . . 0.0 111.25 -177.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -52.74 100.83 0.24 Allowed Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.732 1.613 . . . . 0.0 110.97 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.58 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 74.6 Cg_exo -54.08 -62.36 0.32 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 124.331 3.354 . . . . 0.0 112.642 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.623 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -22.15 -73.8 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.424 2.69 . . . . 0.0 112.708 -174.329 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.623 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 0.4 OUTLIER 40.17 86.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.78 1.632 . . . . 0.0 110.916 -172.082 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -172.08 3.94 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.649 1.58 . . . . 0.0 111.382 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -120.85 94.63 4.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.636 1.575 . . . . 0.0 111.138 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.55 53.01 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.518 1.927 . . . . 0.0 112.004 -171.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.46 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.155 1.782 . . . . 0.0 111.159 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 61.89 141.21 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.147 1.779 . . . . 0.0 110.61 -171.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 pt -112.38 -178.64 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 126.14 1.776 . . . . 0.0 108.995 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.5 p -63.13 170.43 2.85 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.619 1.568 . . . . 0.0 110.013 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -43.94 126.08 4.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.585 1.554 . . . . 0.0 111.409 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -165.77 154.97 11.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.619 1.567 . . . . 0.0 110.727 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 12.9 t -65.49 -35.16 80.07 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.613 1.565 . . . . 0.0 110.338 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.585 1.554 . . . . 0.0 110.162 172.434 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 CA--C 1.545 0.756 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttt 50.12 -157.06 0.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.625 1.57 . . . . 0.0 110.536 -175.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -110.47 141.1 44.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.625 1.57 . . . . 0.0 110.49 -174.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.707 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . -45.77 153.75 0.26 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.628 1.571 . . . . 0.0 111.277 169.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.9 t -143.37 158.5 43.59 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.561 1.544 . . . . 0.0 110.067 167.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 m 60.45 53.65 4.14 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.592 1.557 . . . . 0.0 110.401 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.782 HD13 HH21 ' A' ' 12' ' ' ARG . 0.1 OUTLIER -89.63 19.8 4.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.353 1.861 . . . . 0.0 110.933 178.834 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.0 p -57.89 133.92 55.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.366 1.866 . . . . 0.0 110.816 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.72 -21.68 60.14 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.673 1.589 . . . . 0.0 111.401 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.767 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.782 HH21 HD13 ' A' ' 7' ' ' LEU . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.631 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.767 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.631 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.443 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.894 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.489 ' HD1' HG21 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.031 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.715 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.467 ' CG2' ' HB2' ' A' ' 69' ' ' CYS . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.9 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.594 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.894 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.495 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.495 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.507 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.656 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.518 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.031 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.503 ' HA ' HG11 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.9 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.68 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.881 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.47 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.622 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.34 147.11 95.03 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.31 92.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.861 3.707 . . . . 0.0 113.337 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 -66.35 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.602 1.561 . . . . 0.0 111.198 -174.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -130.78 55.34 1.84 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.117 1.367 . . . . 0.0 110.276 164.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.25 134.83 34.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.572 1.549 . . . . 0.0 111.257 164.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 55.72 69.82 1.77 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.639 1.575 . . . . 0.0 111.049 176.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.479 ' HG2' ' H ' ' A' ' 80' ' ' ARG . 68.2 Cg_endo -68.79 -87.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.175 0 C-N-CA 124.326 3.35 . . . . 0.0 112.665 -170.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.479 ' H ' ' HG2' ' A' ' 79' ' ' PRO . 7.0 ttp180 -21.08 -67.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.39 2.676 . . . . 0.0 112.982 -173.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -16.33 109.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.091 2.556 . . . . 0.0 112.369 171.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' ' N ' ' A' ' 82' ' ' HIS . 2.2 m-70 -94.82 -54.64 3.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.366 1.467 . . . . 0.0 111.341 -164.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.461 ' O ' HD22 ' A' ' 84' ' ' LEU . 8.3 mtm180 47.15 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.165 1.386 . . . . 0.0 110.775 -162.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.461 HD22 ' O ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER 179.47 152.65 0.41 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.485 1.914 . . . . 0.0 111.99 -167.642 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -62.51 -75.44 0.07 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.109 1.764 . . . . 0.0 111.208 177.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.25 161.92 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.261 1.825 . . . . 0.0 110.54 -171.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -84.62 88.94 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 109.024 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.6 m -52.93 -87.71 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.593 1.557 . . . . 0.0 110.076 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.9 p-80 -100.37 -6.53 25.62 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.684 1.593 . . . . 0.0 111.826 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 65.64 -164.51 0.24 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.306 1.442 . . . . 0.0 110.686 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 p -99.37 178.57 4.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.575 1.55 . . . . 0.0 110.367 177.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 110.12 -173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ttt . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 110.732 -0.099 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -124.75 -84.8 0.64 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.569 1.548 . . . . 0.0 110.532 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 10.1 mttt -86.98 97.79 10.9 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.606 1.562 . . . . 0.0 110.508 -170.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 164.94 -46.07 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.595 1.558 . . . . 0.0 111.247 -170.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 m -128.78 87.42 2.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.61 1.564 . . . . 0.0 110.068 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.741 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.1 OUTLIER -179.43 161.39 1.06 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.607 1.563 . . . . 0.0 110.374 -171.639 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -89.68 21.58 3.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.381 1.872 . . . . 0.0 110.901 -173.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.741 HG23 ' HB3' ' A' ' 6' ' ' CYS . 30.2 p -48.52 146.4 2.99 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.23 1.812 . . . . 0.0 110.787 178.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 -63.55 -27.35 69.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.653 1.581 . . . . 0.0 111.401 -170.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.637 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.912 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.756 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.411 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.949 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.778 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.008 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.475 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.783 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.989 HG13 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.989 HG22 HG13 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.566 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.566 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.807 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.857 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.949 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.76 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.473 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.522 ' HD2' HG13 ' A' ' 52' ' ' VAL . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.952 HG22 HG21 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HE1' ' NE ' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.008 ' HB2' HG21 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.583 ' HA ' HG11 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.792 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.434 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.667 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.807 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.667 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.427 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.421 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.568 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.435 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.76 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.49 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -60.13 -52.23 74.83 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.472 ' CG ' ' HG3' ' A' ' 76' ' ' LYS . 62.2 Cg_endo -89.27 -26.25 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 125.071 3.847 . . . . 0.0 113.415 174.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.1 t70 72.52 59.43 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.865 1.666 . . . . 0.0 111.241 -164.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 2.8 mtmt -103.32 45.57 0.95 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.148 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.23 130.48 35.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.601 1.56 . . . . 0.0 111.338 170.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -59.43 106.94 0.82 Allowed Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.608 1.563 . . . . 0.0 111.017 -174.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.12 -11.21 25.09 Favored 'Trans proline' 0 CA--C 1.548 1.177 0 C-N-CA 124.426 3.417 . . . . 0.0 113.095 -169.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -16.99 -88.31 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 128.298 2.639 . . . . 0.0 113.242 -163.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -15.47 109.21 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.458 2.703 . . . . 0.0 112.614 177.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 56.86 118.05 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.729 1.611 . . . . 0.0 111.401 -163.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -100.51 58.19 0.94 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.62 1.168 . . . . 0.0 110.467 161.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.81 HD22 ' H ' ' A' ' 85' ' ' ASP . 2.9 tm? -37.28 142.01 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.063 2.145 . . . . 0.0 111.366 -177.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.81 ' H ' HD22 ' A' ' 84' ' ' LEU . 10.4 t70 -45.35 -71.97 0.07 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.497 1.519 . . . . 0.0 111.2 -170.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 166.18 -168.6 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.459 1.904 . . . . 0.0 110.682 168.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 mp 72.48 153.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.884 1.674 . . . . 0.0 109.001 165.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 m -78.97 -59.02 2.95 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.616 1.566 . . . . 0.0 110.099 175.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.3 t60 55.03 95.41 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.585 1.554 . . . . 0.0 111.387 -173.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.22 -72.24 0.26 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.599 1.56 . . . . 0.0 110.726 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.7 p -165.41 141.38 5.33 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 110.377 -178.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.619 1.568 . . . . 0.0 110.167 -174.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.4 -153.57 0.27 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.673 1.589 . . . . 0.0 110.526 -166.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER 83.41 124.4 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.581 1.552 . . . . 0.0 110.525 172.441 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.21 -19.12 0.43 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 111.495 175.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.83 -27.04 12.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.522 1.529 . . . . 0.0 110.063 -168.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 m 45.85 54.86 7.5 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.563 1.545 . . . . 0.0 110.361 -174.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.461 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.3 OUTLIER -89.66 19.65 4.52 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.427 1.891 . . . . 0.0 110.926 -169.319 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.6 p -51.74 124.77 13.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.835 1.654 . . . . 0.0 110.775 -175.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -72.72 -22.09 60.94 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.518 1.527 . . . . 0.0 111.309 -165.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.954 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.507 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.524 ' CG ' ' HB2' ' A' ' 49' ' ' ARG . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.567 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.513 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.503 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.827 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.98 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.629 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.886 HG21 HG22 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.537 HG22 HG13 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.906 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.906 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.927 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.495 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.949 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.949 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.964 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.524 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.886 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.507 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.98 ' HB2' HG21 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG11 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.927 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.423 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.504 ' CG ' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.423 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.558 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.501 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.484 ' HB2' HG21 ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.964 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.664 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -87.56 162.03 43.49 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -39.63 90.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.06 1 C-N-CA 125.438 4.092 . . . . 0.0 113.954 -163.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.7 t0 -169.21 -72.12 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.518 1.527 . . . . 0.0 111.228 -174.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.74 124.82 30.6 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.991 1.316 . . . . 0.0 110.266 167.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.92 140.06 16.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.729 1.612 . . . . 0.0 111.267 -171.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.92 163.72 20.42 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.506 1.523 . . . . 0.0 110.922 -175.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.67 149.92 1.74 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.268 3.312 . . . . 0.0 112.465 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.529 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 2.0 ttt-85 24.64 -105.51 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.946 2.099 . . . . 0.0 112.05 -168.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 4.4 mt-30 160.39 151.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.845 2.458 . . . . 0.0 111.802 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.62 -25.58 11.27 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.792 1.637 . . . . 0.0 111.473 -175.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 32.25 55.51 0.35 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.39 1.476 . . . . 0.0 110.5 -161.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.805 HD22 ' N ' ' A' ' 85' ' ' ASP . 1.3 tm? -33.86 129.2 0.34 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.395 2.278 . . . . 0.0 112.254 -162.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.805 ' N ' HD22 ' A' ' 84' ' ' LEU . 4.1 p-10 -63.37 -142.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.391 1.876 . . . . 0.0 111.305 175.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 169.03 -39.2 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 0.0 110.513 165.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 41.52 79.63 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 126.189 1.796 . . . . 0.0 109.026 -178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -63.99 140.95 58.92 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.562 1.545 . . . . 0.0 110.025 -166.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -146.41 127.35 14.52 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.618 1.567 . . . . 0.0 111.452 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.98 157.87 36.68 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.755 -176.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.22 156.02 36.22 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.634 1.574 . . . . 0.0 110.375 -176.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 125.595 1.558 . . . . 0.0 110.123 -171.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 110.715 -0.106 . . . . 0.0 110.715 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -111.88 29.81 7.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.612 1.565 . . . . 0.0 110.502 -170.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 1.1 ttpt -172.21 -147.72 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.596 1.558 . . . . 0.0 110.518 -173.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.12 -89.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.607 1.563 . . . . 0.0 111.251 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 41.21 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.584 1.554 . . . . 0.0 110.062 -173.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 87.04 4.03 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.542 1.537 . . . . 0.0 110.35 -176.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.566 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.64 17.9 6.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.433 1.893 . . . . 0.0 110.918 173.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.1 p -48.03 125.96 9.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.167 1.787 . . . . 0.0 110.767 -171.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -60.82 -34.92 75.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.838 1.655 . . . . 0.0 111.436 -170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.949 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.566 ' NH1' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.828 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.949 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.711 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.518 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.914 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.023 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.644 ' HD1' HG21 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.748 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.972 HG21 HG22 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.573 HG22 HG13 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.599 ' H ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.936 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.914 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.853 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.853 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.439 ' HA ' HG13 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.972 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.518 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.023 ' HB2' HG21 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.728 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.936 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.728 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.543 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.721 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.748 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.448 ' HB2' ' HG2' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.448 ' HG2' ' HB2' ' A' ' 68' ' ' PRO . 7.5 tp60 -55.61 111.44 3.11 Favored Pre-proline 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -25.21 81.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.121 1 C-N-CA 126.597 4.865 . . . . 0.0 115.169 -162.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.1 t0 67.19 63.8 0.44 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.726 2.01 . . . . 0.0 111.263 172.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -90.87 25.64 2.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.029 1.332 . . . . 0.0 110.378 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.42 165.25 16.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.612 1.565 . . . . 0.0 111.273 -167.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -115.18 134.5 22.54 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.625 1.57 . . . . 0.0 110.988 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.41 97.87 0.72 Allowed 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 124.39 3.393 . . . . 0.0 112.565 170.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -20.74 -70.03 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.72 2.408 . . . . 0.0 112.399 170.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 44.8 40.04 3.96 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.868 1.667 . . . . 0.0 111.0 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.85 124.24 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.56 1.544 . . . . 0.0 111.387 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.91 99.8 0.14 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.653 1.581 . . . . 0.0 111.114 165.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.617 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.3 tt 179.54 122.2 0.06 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.379 1.872 . . . . 0.0 111.911 -173.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.617 ' N ' HD23 ' A' ' 84' ' ' LEU . 14.5 t0 27.8 -86.02 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 128.132 2.573 . . . . 0.0 112.368 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 163.59 151.06 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.657 1.583 . . . . 0.0 110.586 -168.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 46.2 mm -80.48 90.17 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.698 1.599 . . . . 0.0 109.0 -171.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -73.78 166.19 23.76 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.609 1.564 . . . . 0.0 110.041 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 71.47 169.08 0.32 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.644 1.577 . . . . 0.0 111.394 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -123.12 168.9 11.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.612 1.565 . . . . 0.0 110.699 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -84.29 123.61 30.35 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.619 1.568 . . . . 0.0 110.385 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.607 1.563 . . . . 0.0 110.186 -178.978 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.725 -0.102 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -55.77 -26.64 46.88 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.63 1.572 . . . . 0.0 110.515 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 4' ' ' ALA . 12.1 ttmm -85.25 155.17 21.51 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.604 1.562 . . . . 0.0 110.5 -175.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.4 ' N ' ' HG2' ' A' ' 3' ' ' LYS . . . -47.94 114.69 0.97 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.6 1.56 . . . . 0.0 111.246 178.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 70.55 164.07 0.26 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.591 1.556 . . . . 0.0 110.049 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 11' ' ' GLN . 38.6 m -93.1 73.53 4.68 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 110.386 -168.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.87 21.79 3.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.339 1.856 . . . . 0.0 110.915 -168.864 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 79.4 p -48.67 167.69 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.285 1.834 . . . . 0.0 110.851 176.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -68.25 -24.27 64.88 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.804 1.641 . . . . 0.0 111.339 -173.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.84 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.757 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.84 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.811 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.44 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.585 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.413 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.928 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.402 ' HB3' ' CD ' ' A' ' 39' ' ' ARG . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.01 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.647 ' HD2' HG23 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.752 HG21 HG22 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.496 HG23 ' N ' ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.496 ' N ' HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.868 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.649 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.928 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.413 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.628 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.587 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 51' ' ' ASN . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 48' ' ' LEU . 66.7 m-20 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.752 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.523 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.01 ' HB2' HG21 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.868 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.496 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.713 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.496 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.423 ' HG3' ' N ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.434 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.484 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.628 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.487 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -68.43 115.11 26.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -40.32 91.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 1 C-N-CA 125.668 4.246 . . . . 0.0 113.433 -163.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -134.45 -60.78 0.79 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.272 1.829 . . . . 0.0 111.153 174.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.7 tttt -129.67 38.26 3.87 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.334 1.454 . . . . 0.0 110.346 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 71' ' ' ARG . . . -89.16 117.28 28.03 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.543 1.537 . . . . 0.0 111.212 164.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 72.37 119.14 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.656 1.582 . . . . 0.0 111.034 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -71.31 136.51 29.11 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.368 3.378 . . . . 0.0 112.625 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -18.0 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.935 2.494 . . . . 0.0 112.763 168.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 159.8 -52.85 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 127.668 2.387 . . . . 0.0 111.884 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 p80 43.32 85.91 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.004 1.722 . . . . 0.0 111.51 169.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -53.67 112.71 0.98 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.597 1.559 . . . . 0.0 111.13 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.607 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.3 OUTLIER 179.48 134.48 0.1 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.49 1.916 . . . . 0.0 111.904 -171.356 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.607 ' H ' HD23 ' A' ' 84' ' ' LEU . 3.0 t0 -151.07 -142.24 0.12 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.764 1.626 . . . . 0.0 111.089 -166.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 90.16 -10.21 0.34 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.737 . . . . 0.0 110.802 163.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -115.53 169.91 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.038 1.735 . . . . 0.0 108.953 165.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.5 p -69.38 -36.19 76.57 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.74 1.616 . . . . 0.0 110.028 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 83.33 23.57 0.14 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.62 1.568 . . . . 0.0 111.445 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.06 131.57 43.05 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.598 1.559 . . . . 0.0 110.695 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -158.44 145.07 17.41 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.626 1.57 . . . . 0.0 110.384 173.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 . . . . . 0 N--CA 1.469 0.52 0 C-N-CA 125.559 1.543 . . . . 0.0 110.139 173.352 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ptp . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.78 -98.13 0.12 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.652 1.581 . . . . 0.0 110.483 -178.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 38.41 49.37 1.35 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.602 1.561 . . . . 0.0 110.535 -170.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 45.17 80.92 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.595 1.558 . . . . 0.0 111.256 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.846 ' CG2' HD23 ' A' ' 7' ' ' LEU . 2.1 m -157.32 126.39 5.87 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.584 1.553 . . . . 0.0 110.011 -176.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 m -102.74 70.25 1.11 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.601 1.56 . . . . 0.0 110.379 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.846 HD23 ' CG2' ' A' ' 5' ' ' THR . 0.5 OUTLIER -89.43 24.99 2.07 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.344 1.858 . . . . 0.0 110.91 -171.694 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 m -58.11 165.72 1.82 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.486 1.914 . . . . 0.0 110.749 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 -65.65 -16.57 63.86 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.467 1.507 . . . . 0.0 111.328 -171.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.823 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.45 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.701 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.823 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.779 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.517 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.44 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.678 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.838 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.825 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.998 HG21 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.842 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.739 ' CG2' HG22 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.462 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.489 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.489 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.888 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.838 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.825 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.44 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.605 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.745 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.533 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.436 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.739 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.998 ' HB2' HG21 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.555 ' HA ' HG11 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.888 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.457 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.524 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.929 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.415 ' HG3' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.441 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.745 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.441 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -59.46 -52.56 73.38 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.439 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 59.2 Cg_endo -88.11 -32.83 0.14 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.9 3.734 . . . . 0.0 113.411 171.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 t0 75.25 60.61 0.06 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.146 1.778 . . . . 0.0 111.139 -163.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -113.51 30.57 7.13 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.556 1.542 . . . . 0.0 110.248 -172.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.21 150.97 24.44 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.604 1.562 . . . . 0.0 111.224 166.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.07 117.84 68.52 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.612 1.565 . . . . 0.0 110.99 -172.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -46.96 -55.29 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.283 3.322 . . . . 0.0 112.49 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -14.76 -88.09 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.683 2.393 . . . . 0.0 112.653 163.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 72.97 51.97 0.14 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.098 1.759 . . . . 0.0 111.013 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.0 129.29 0.07 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.029 1.731 . . . . 0.0 111.391 164.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 54.74 3.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.805 1.242 . . . . 0.0 110.47 161.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.686 HD22 ' O ' ' A' ' 86' ' ' LYS . 2.5 tt -36.02 114.73 0.29 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.242 2.217 . . . . 0.0 112.167 -162.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.98 -69.08 0.35 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.525 1.53 . . . . 0.0 111.226 -177.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.686 ' O ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -38.7 155.86 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.745 1.618 . . . . 0.0 110.566 170.942 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.0 122.77 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.536 1.534 . . . . 0.0 108.963 171.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -70.11 -84.04 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.641 1.576 . . . . 0.0 110.086 -173.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 76.32 129.06 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.58 1.552 . . . . 0.0 111.396 167.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 57.96 95.8 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.519 1.528 . . . . 0.0 110.712 172.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.56 84.33 0.18 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.618 1.567 . . . . 0.0 110.388 170.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.617 1.567 . . . . 0.0 110.142 -173.433 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.712 -0.107 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.7 28.54 5.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.584 1.554 . . . . 0.0 110.491 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 2.4 ttpt -167.49 145.79 4.76 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.63 1.572 . . . . 0.0 110.551 -172.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 80.69 151.67 0.11 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.585 1.554 . . . . 0.0 111.256 174.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -157.38 -44.68 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.724 1.61 . . . . 0.0 110.029 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.7 p 33.3 89.36 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.681 2.392 . . . . 0.0 111.151 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 21.43 3.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.361 1.864 . . . . 0.0 110.921 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -52.84 172.45 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.106 1.762 . . . . 0.0 110.774 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -80.0 -28.08 39.48 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.361 1.464 . . . . 0.0 111.317 -169.395 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.531 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.827 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.8 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.524 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.627 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.429 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.627 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.649 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.422 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.981 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.455 ' C ' ' CD1' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.044 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.672 HG11 HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.672 HG22 HG11 ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.788 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.788 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.859 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.826 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.826 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.429 ' HB3' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.553 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.553 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.589 ' HD2' ' H ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.517 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.827 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.531 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.044 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.489 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.859 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.489 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.638 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.618 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.415 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.857 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.514 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.475 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.464 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.442 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.492 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -74.32 133.08 78.12 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.66 93.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.428 3.419 . . . . 0.0 113.109 -171.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.442 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -142.91 -74.62 0.28 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.601 1.56 . . . . 0.0 111.202 -178.202 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -129.47 71.47 1.44 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.938 1.295 . . . . 0.0 110.231 168.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.55 174.68 11.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.848 1.659 . . . . 0.0 111.254 169.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 23.6 t30 85.82 142.84 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.775 1.63 . . . . 0.0 110.947 166.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.69 157.0 59.83 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.402 3.401 . . . . 0.0 112.585 -166.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.413 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 1.8 ttt180 24.7 -105.58 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.238 2.215 . . . . 0.0 112.128 -171.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.413 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER 47.67 62.55 2.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.822 1.649 . . . . 0.0 110.994 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -90.58 -26.31 19.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.667 1.587 . . . . 0.0 111.434 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 71.22 81.65 0.15 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.584 1.554 . . . . 0.0 111.132 -170.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 179.48 107.64 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.504 1.921 . . . . 0.0 111.939 -176.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.49 -60.84 1.76 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.61 1.564 . . . . 0.0 111.187 -171.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.88 38.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.581 1.552 . . . . 0.0 110.499 170.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.32 73.73 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.553 1.541 . . . . 0.0 108.932 169.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.1 p -58.72 163.27 3.4 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.593 1.557 . . . . 0.0 110.079 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -90.95 90.9 8.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.655 1.582 . . . . 0.0 111.397 -171.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.87 -75.12 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.564 1.546 . . . . 0.0 110.742 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 24.8 t -73.64 153.68 40.05 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.574 1.549 . . . . 0.0 110.371 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 125.555 1.542 . . . . 0.0 110.15 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 120.3 0.095 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt 48.91 56.79 7.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.61 1.564 . . . . 0.0 110.497 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -88.07 -29.94 20.27 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.605 1.562 . . . . 0.0 110.484 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 50.78 -92.43 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.61 1.564 . . . . 0.0 111.254 171.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -94.86 133.85 38.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.589 1.555 . . . . 0.0 110.057 -165.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 m -98.58 111.86 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.644 1.578 . . . . 0.0 110.41 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.783 HD12 ' NH1' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -89.61 23.33 2.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.398 1.879 . . . . 0.0 110.891 -179.094 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.412 HG22 ' H ' ' A' ' 9' ' ' ASP . 3.2 m -52.98 172.73 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.275 1.83 . . . . 0.0 110.817 173.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' H ' HG22 ' A' ' 8' ' ' THR . 1.9 p30 -62.72 -27.26 69.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.611 1.564 . . . . 0.0 111.384 -178.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.008 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.783 ' NH1' HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.673 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.732 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.419 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.679 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.684 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.805 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.608 ' O ' ' HD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.727 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.813 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.813 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.533 HG23 ' H ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.533 ' H ' HG23 ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.022 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.53 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.872 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.872 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.435 ' HB3' ' HD2' ' A' ' 39' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.753 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.496 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.75 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.533 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.805 ' HB2' HG21 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.722 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 1.022 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.722 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.531 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.727 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.496 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.496 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.461 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.753 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.458 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.761 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -72.99 128.46 87.9 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -34.78 90.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.065 1 C-N-CA 126.071 4.514 . . . . 0.0 113.975 -174.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -150.33 -79.23 0.13 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.804 1.642 . . . . 0.0 111.216 -169.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.16 64.1 1.1 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.287 1.435 . . . . 0.0 110.357 -178.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -81.65 120.21 24.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.426 1.491 . . . . 0.0 111.258 164.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.54 ' ND2' ' HD2' ' A' ' 79' ' ' PRO . 12.4 t-20 -167.2 138.55 2.59 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.485 1.514 . . . . 0.0 110.998 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.54 ' HD2' ' ND2' ' A' ' 78' ' ' ASN . 64.6 Cg_endo -81.33 47.54 2.58 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.57 3.513 . . . . 0.0 113.037 172.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.5 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.789 2.436 . . . . 0.0 112.482 170.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 48.05 -94.55 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.789 1.636 . . . . 0.0 111.022 178.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -57.02 153.28 11.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.587 1.555 . . . . 0.0 111.469 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.98 60.56 5.52 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.025 1.33 . . . . 0.0 110.429 161.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.728 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -44.96 165.33 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.597 2.359 . . . . 0.0 113.108 -172.812 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -133.06 -65.26 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 125.511 1.524 . . . . 0.0 111.223 -171.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt 64.35 27.23 13.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 0.0 110.571 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -140.91 128.85 23.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 125.63 1.572 . . . . 0.0 108.996 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.8 m -87.57 -61.97 1.6 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.601 1.56 . . . . 0.0 110.054 -174.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.2 59.22 2.21 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.655 1.582 . . . . 0.0 111.415 -170.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 82.58 120.97 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.587 1.555 . . . . 0.0 110.713 170.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 8.2 p -91.0 -26.46 19.2 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.637 1.575 . . . . 0.0 110.412 176.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.625 1.57 . . . . 0.0 110.147 174.729 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 CA-C-O 120.714 0.292 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 tttt 78.18 -70.69 0.11 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.784 1.634 . . . . 0.0 110.552 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 tttt 74.1 73.88 0.12 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.559 1.544 . . . . 0.0 110.519 170.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -43.4 98.06 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.616 1.567 . . . . 0.0 111.275 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -147.96 139.8 23.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.59 1.556 . . . . 0.0 110.035 172.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.8 m -108.13 102.99 12.1 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.65 1.58 . . . . 0.0 110.389 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.562 HD13 HH12 ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.53 23.74 2.51 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.407 1.883 . . . . 0.0 110.924 174.221 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.2 p -56.39 145.31 27.7 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.343 1.857 . . . . 0.0 110.799 175.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -57.73 -24.48 57.14 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.514 1.526 . . . . 0.0 111.325 177.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.643 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.562 HH12 HD13 ' A' ' 7' ' ' LEU . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.68 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.643 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.739 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.406 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.89 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.575 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.575 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.015 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.589 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.046 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.656 HG23 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.667 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.635 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.87 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.492 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.89 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.423 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.529 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.637 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.656 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.589 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.556 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.046 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.559 ' C ' HG12 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.87 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.434 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.742 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.434 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.661 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.667 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.465 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.479 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.637 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -47.73 129.3 11.17 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -33.53 82.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.09 1 C-N-CA 126.272 4.648 . . . . 0.0 115.818 -162.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.3 t70 58.57 56.76 4.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.079 1.752 . . . . 0.0 111.129 160.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.51 ' HE3' ' HA ' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.49 4.5 20.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.476 1.11 . . . . 0.0 110.666 175.359 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.466 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -78.46 169.55 18.08 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.64 1.576 . . . . 0.0 111.444 -166.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -102.12 80.43 0.3 Allowed Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.831 1.652 . . . . 0.0 111.023 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.466 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 76.1 Cg_exo -55.3 96.55 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.317 3.345 . . . . 0.0 112.581 -165.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.76 -72.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.713 2.405 . . . . 0.0 112.371 168.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.51 -176.72 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.982 1.713 . . . . 0.0 110.981 177.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -24.54 15.33 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.634 1.574 . . . . 0.0 111.371 176.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtm180 65.03 87.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.599 1.559 . . . . 0.0 111.114 -178.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.429 ' CD2' ' N ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER 179.52 127.0 0.07 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.513 1.925 . . . . 0.0 111.921 -176.107 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.429 ' N ' ' CD2' ' A' ' 84' ' ' LEU . 0.4 OUTLIER -119.55 -84.77 0.66 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.614 1.566 . . . . 0.0 111.189 -167.292 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -40.17 115.52 0.55 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.836 1.654 . . . . 0.0 110.627 177.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 64.1 mt 56.78 89.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.567 1.547 . . . . 0.0 108.978 165.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.1 p -62.45 172.68 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.587 1.555 . . . . 0.0 110.062 171.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.96 39.74 3.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.578 1.551 . . . . 0.0 111.442 -170.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -92.26 121.3 33.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.555 1.542 . . . . 0.0 110.705 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -127.16 -71.48 0.67 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.571 1.548 . . . . 0.0 110.161 -178.542 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.2 mtt . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.376 0.131 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 tptt 52.54 96.2 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.614 1.566 . . . . 0.0 110.501 -171.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 14.9 mttm 39.49 -108.41 0.08 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.959 1.703 . . . . 0.0 110.4 -165.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 158.13 -152.76 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.594 1.558 . . . . 0.0 111.351 -164.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 m 89.03 34.65 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.019 1.728 . . . . 0.0 110.122 164.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 65.5 76.39 0.33 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.573 1.549 . . . . 0.0 110.584 164.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.67 19.5 4.62 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.369 1.868 . . . . 0.0 110.973 -175.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.491 HG22 ' OD1' ' A' ' 9' ' ' ASP . 2.5 m -59.15 170.93 0.81 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.333 1.853 . . . . 0.0 110.875 -175.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.534 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 -60.22 -27.31 67.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.185 1.394 . . . . 0.0 111.292 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.902 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.531 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.701 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.902 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.407 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.776 HG21 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.511 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.653 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.946 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.855 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.775 HG23 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.719 HG22 HG13 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.582 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.007 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.497 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.653 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.776 ' HA ' HG21 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.485 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.775 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.534 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.559 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.531 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.052 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.542 ' HA ' HG11 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.892 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.54 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 1.052 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.601 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.401 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.401 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.527 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -78.78 -59.16 0.68 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.433 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 85.0 Cg_endo -86.76 -22.17 1.99 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.125 3.883 . . . . 0.0 113.003 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.0 t0 66.86 59.15 0.57 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.543 1.537 . . . . 0.0 110.966 -162.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.431 ' HB3' ' HG3' ' A' ' 70' ' ' LYS . 0.5 OUTLIER -83.38 150.59 25.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.977 1.311 . . . . 0.0 110.263 -162.317 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -88.89 158.1 18.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.746 1.618 . . . . 0.0 111.251 -175.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.406 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 18.2 p30 -57.77 168.68 1.03 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.595 1.558 . . . . 0.0 110.978 -177.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 84.9 Cg_exo -47.07 108.24 0.15 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.314 3.342 . . . . 0.0 112.563 176.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.425 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 2.9 ttm-85 23.56 -109.65 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.278 2.231 . . . . 0.0 111.772 -168.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.425 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 1.6 tt0 31.05 73.83 0.05 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.105 2.162 . . . . 0.0 111.616 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -60.65 -28.21 68.39 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.366 1.466 . . . . 0.0 111.374 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.67 99.14 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.551 1.54 . . . . 0.0 111.09 -164.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.2 OUTLIER 179.49 116.27 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.475 1.91 . . . . 0.0 111.943 -171.052 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.44 ' N ' HD22 ' A' ' 84' ' ' LEU . 1.8 p-10 -63.07 -156.75 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.228 1.811 . . . . 0.0 111.251 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 mttt 163.44 88.31 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.728 1.611 . . . . 0.0 110.512 -171.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.2 mt -100.96 149.56 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.617 1.567 . . . . 0.0 108.95 -171.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 p -78.32 -167.32 1.02 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.624 1.569 . . . . 0.0 110.024 175.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -100.01 -30.36 12.03 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.611 1.565 . . . . 0.0 111.405 -170.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.92 143.51 50.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.572 1.549 . . . . 0.0 110.742 -173.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.33 158.7 17.25 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.594 1.558 . . . . 0.0 110.345 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.546 1.538 . . . . 0.0 110.144 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 110.713 -0.106 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.6 mttp -134.06 -164.34 1.49 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.591 1.557 . . . . 0.0 110.508 -172.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt 69.3 115.67 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.59 1.556 . . . . 0.0 110.555 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 67.44 112.37 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.591 1.556 . . . . 0.0 111.281 -170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.3 95.53 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.592 1.557 . . . . 0.0 110.051 -167.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 m -122.18 131.96 54.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 110.342 -170.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.509 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -89.66 22.65 2.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.916 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.5 p -51.75 146.95 7.25 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.295 1.838 . . . . 0.0 110.81 174.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.423 ' HA ' ' HD2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER -57.17 -23.68 49.18 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.497 1.519 . . . . 0.0 111.418 -170.163 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.953 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.852 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.953 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.726 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.904 HG21 ' HA ' ' A' ' 40' ' ' PRO . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.431 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.576 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.681 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.953 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.402 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.924 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.982 HG21 HG22 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.852 HG22 HG13 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.59 HG23 ' H ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.59 ' H ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.956 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.576 ' HG2' ' CB ' ' A' ' 24' ' ' ASP . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.904 ' HA ' HG21 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.431 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.792 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.792 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.673 ' CB ' HG12 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.529 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.982 HG22 HG21 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.953 ' HB2' HG21 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.956 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.687 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.587 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.671 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.49 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -81.22 172.06 10.68 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -55.12 82.12 0.03 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 124.357 3.372 . . . . 0.0 112.951 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -162.34 -70.57 0.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.943 1.697 . . . . 0.0 111.092 -168.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -100.96 85.69 2.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.802 1.241 . . . . 0.0 110.236 163.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.714 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -51.68 175.92 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.947 1.699 . . . . 0.0 111.429 166.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -89.14 79.19 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.997 1.719 . . . . 0.0 111.073 171.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.714 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 69.0 Cg_endo -79.87 7.06 4.82 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.473 3.449 . . . . 0.0 113.068 -168.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 ttp180 -24.02 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.863 2.465 . . . . 0.0 112.814 -161.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -25.56 -87.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 127.022 2.129 . . . . 0.0 111.658 167.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -148.6 -57.11 0.22 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.235 1.814 . . . . 0.0 110.95 160.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.26 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.565 1.946 . . . . 0.0 111.075 -172.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 mt 179.69 92.08 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.472 1.909 . . . . 0.0 112.142 -166.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -125.4 -68.71 0.82 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.886 2.075 . . . . 0.0 111.117 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -30.58 124.47 0.19 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.532 1.933 . . . . 0.0 110.873 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.75 155.14 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.806 1.642 . . . . 0.0 108.989 165.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.3 m -46.9 -51.49 16.66 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.585 1.554 . . . . 0.0 110.077 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 20.6 t60 -96.62 -71.42 0.68 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.571 1.548 . . . . 0.0 111.408 172.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 166.34 -41.92 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.581 1.552 . . . . 0.0 110.706 -176.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -123.19 -174.91 3.06 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.607 1.563 . . . . 0.0 110.385 -174.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.639 1.575 . . . . 0.0 110.193 -177.789 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -71.84 -27.52 62.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.571 1.548 . . . . 0.0 110.52 177.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.1 -178.32 3.49 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.603 1.561 . . . . 0.0 110.522 170.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 71.27 97.16 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.57 1.548 . . . . 0.0 111.29 -172.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.748 HG21 HD23 ' A' ' 7' ' ' LEU . 1.0 OUTLIER 63.53 112.92 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.61 1.564 . . . . 0.0 110.05 -175.503 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 m -99.61 74.74 1.89 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.556 1.543 . . . . 0.0 110.393 175.212 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.748 HD23 HG21 ' A' ' 5' ' ' THR . 0.2 OUTLIER -89.73 19.79 4.49 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.394 1.878 . . . . 0.0 110.92 -172.49 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p -48.52 152.43 0.93 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.291 1.836 . . . . 0.0 110.874 -175.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -60.55 -23.63 64.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.689 1.596 . . . . 0.0 111.377 173.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.003 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.562 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.76 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.003 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 1.031 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.485 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.6 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.579 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.73 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.957 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.645 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.726 HG23 ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.68 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.68 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.969 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.579 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 1.031 ' HA ' HG21 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.485 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.818 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.818 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.726 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.663 HG22 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.562 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.957 ' HB2' HG21 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.628 ' HA ' HG11 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.969 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.428 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.442 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.834 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.691 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.616 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.469 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.458 ' HD3' ' HB2' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -79.43 136.65 56.1 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -32.51 87.56 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.095 1 C-N-CA 126.41 4.74 . . . . 0.0 114.477 -164.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -153.9 -69.13 0.14 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.22 1.808 . . . . 0.0 111.115 -175.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.29 24.19 12.84 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.294 1.437 . . . . 0.0 110.462 164.269 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.41 124.01 34.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.502 1.521 . . . . 0.0 111.337 165.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 62.85 72.7 0.57 Allowed Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.511 1.524 . . . . 0.0 110.995 172.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.42 -31.68 48.99 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.309 3.339 . . . . 0.0 112.613 -177.377 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.1 OUTLIER -15.85 -100.76 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 128.4 2.68 . . . . 0.0 113.031 -163.448 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 0.1 OUTLIER 31.62 76.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.964 2.106 . . . . 0.0 111.553 -175.572 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 63.06 151.92 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.312 1.445 . . . . 0.0 111.402 -174.686 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -112.11 58.07 0.64 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.828 1.251 . . . . 0.0 110.43 160.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -38.62 133.4 1.05 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.132 2.173 . . . . 0.0 111.488 -178.26 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.639 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -101.56 150.99 22.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.321 1.448 . . . . 0.0 111.236 174.864 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 tptt 63.27 117.82 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.818 1.647 . . . . 0.0 110.538 -170.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.9 tp 178.14 98.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 125.627 1.571 . . . . 0.0 108.927 169.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -84.48 -38.26 20.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.59 1.556 . . . . 0.0 110.049 -173.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.28 149.04 30.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.613 1.565 . . . . 0.0 111.419 -170.396 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -113.12 -75.83 0.6 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 110.732 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.32 -35.71 12.28 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.619 1.568 . . . . 0.0 110.357 -171.286 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.59 1.556 . . . . 0.0 110.145 -179.076 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 110.671 -0.122 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -160.47 130.35 5.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.575 1.55 . . . . 0.0 110.51 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 tttt 72.32 42.67 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.615 1.566 . . . . 0.0 110.543 -177.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 173.63 134.62 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.604 1.562 . . . . 0.0 111.234 -171.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.5 p -67.01 171.98 4.95 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.559 1.543 . . . . 0.0 110.106 179.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -103.55 118.59 37.09 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.611 1.565 . . . . 0.0 110.362 -172.864 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -89.71 22.86 2.89 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.375 1.87 . . . . 0.0 110.841 178.112 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 p -48.96 172.24 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.388 1.875 . . . . 0.0 110.882 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.526 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER -76.0 -32.75 59.57 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.275 1.43 . . . . 0.0 111.073 -178.591 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.02 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.788 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.02 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.765 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 1.072 HG21 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.541 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.482 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.564 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.923 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.564 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.991 HG21 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.048 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.556 HG13 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.494 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.556 HG22 HG13 ' A' ' 31' ' ' VAL . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.532 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.839 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.488 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.923 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 1.072 ' HB3' HG21 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.482 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.724 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.5 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.526 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.575 HG12 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.529 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.048 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.839 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.431 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.577 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.624 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.905 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.469 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' HG21 ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.437 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.724 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.51 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 -63.2 120.86 65.47 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -39.77 91.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 125.162 3.908 . . . . 0.0 113.828 -167.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.437 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 49.7 t0 -145.7 -71.88 0.25 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.028 1.731 . . . . 0.0 111.115 -168.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.512 ' HA ' ' HG3' ' A' ' 79' ' ' PRO . 0.8 OUTLIER -131.59 60.04 1.68 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.797 1.239 . . . . 0.0 110.303 163.853 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.44 74.46 7.75 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.803 1.641 . . . . 0.0 111.343 165.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 38.7 58.51 5.53 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.636 1.574 . . . . 0.0 111.058 -167.764 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.512 ' HG3' ' HA ' ' A' ' 76' ' ' LYS . 72.1 Cg_endo -70.66 -36.4 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.364 3.376 . . . . 0.0 112.663 175.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -21.46 -78.26 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.299 2.64 . . . . 0.0 112.847 -168.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 5.22 82.86 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.522 2.729 . . . . 0.0 112.58 -168.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.7 146.91 5.84 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.399 1.48 . . . . 0.0 111.543 177.091 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -96.19 78.54 3.12 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.772 1.629 . . . . 0.0 111.104 168.081 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.692 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER 179.51 160.9 0.8 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.512 1.925 . . . . 0.0 111.918 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.692 ' H ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -111.67 -71.6 0.75 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.592 1.557 . . . . 0.0 111.215 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -39.09 137.03 0.75 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.588 1.555 . . . . 0.0 110.489 172.454 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.2 tt -170.35 95.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.593 1.557 . . . . 0.0 108.938 173.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.9 m -75.21 89.99 2.55 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.595 1.558 . . . . 0.0 110.056 171.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.41 ' CE1' ' HB1' ' A' ' 90' ' ' ALA . 1.9 p80 -78.16 -34.03 49.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.648 1.579 . . . . 0.0 111.428 -177.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.41 ' HB1' ' CE1' ' A' ' 89' ' ' HIS . . . -155.29 -69.48 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.578 1.551 . . . . 0.0 110.7 -179.621 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.1 p -167.13 -46.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.597 1.559 . . . . 0.0 110.362 -178.438 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.649 1.58 . . . . 0.0 110.135 -176.237 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 mmt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -125.81 50.59 1.83 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.618 1.567 . . . . 0.0 110.538 172.684 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt 49.63 40.41 19.62 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.609 1.564 . . . . 0.0 110.52 -176.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.47 -151.87 0.23 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.538 1.535 . . . . 0.0 111.247 167.636 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.3 141.69 0.91 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.601 1.56 . . . . 0.0 110.011 177.43 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.791 ' HB2' HG23 ' A' ' 8' ' ' THR . 7.8 p -43.53 122.78 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.592 1.557 . . . . 0.0 110.436 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.72 23.28 2.73 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.377 1.871 . . . . 0.0 110.899 176.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.791 HG23 ' HB2' ' A' ' 6' ' ' CYS . 20.9 p -53.11 141.62 22.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.404 1.882 . . . . 0.0 110.827 174.544 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.703 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 -61.36 -28.35 69.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.754 1.621 . . . . 0.0 111.447 176.039 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.42 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.03 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.703 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.813 ' CZ3' HG12 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.03 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.777 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.514 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.475 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.777 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.784 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.97 HG22 ' HD2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 1.039 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.748 HG21 HG22 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.464 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.464 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.98 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.98 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.475 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 46' ' ' HIS . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.897 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.897 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.68 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.42 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.813 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.514 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.608 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.608 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.562 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.752 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.463 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.46 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.697 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.68 133.89 86.44 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -40.27 91.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 125.085 3.856 . . . . 0.0 113.957 -163.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.4 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.5 t0 -149.19 -67.1 0.22 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.172 1.789 . . . . 0.0 111.176 -177.841 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -145.0 96.21 2.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.168 1.387 . . . . 0.0 110.505 169.353 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.68 174.48 1.01 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.566 1.546 . . . . 0.0 111.329 -175.481 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -35.94 149.44 0.13 Allowed Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.987 1.715 . . . . 0.0 111.133 171.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.683 ' HD3' ' NH1' ' A' ' 43' ' ' ARG . 87.3 Cg_exo -50.98 134.36 42.34 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.314 3.342 . . . . 0.0 112.606 177.489 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.33 -76.1 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.864 2.466 . . . . 0.0 112.486 169.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -16.09 84.26 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 128.63 2.772 . . . . 0.0 112.819 -168.122 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -37.88 7.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.809 1.643 . . . . 0.0 111.225 163.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 26.96 59.42 0.08 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.25 1.82 . . . . 0.0 111.074 -160.983 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.842 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER -37.02 127.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.954 2.102 . . . . 0.0 111.492 -178.517 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.842 ' N ' HD22 ' A' ' 84' ' ' LEU . 2.7 t0 -114.11 -83.22 0.61 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.224 1.41 . . . . 0.0 111.237 179.459 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 160.94 86.07 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.037 1.735 . . . . 0.0 110.36 -168.631 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 56.91 53.73 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.512 1.525 . . . . 0.0 108.963 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -61.34 -61.09 2.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.571 1.549 . . . . 0.0 110.096 174.133 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -115.69 153.5 31.23 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.609 1.563 . . . . 0.0 111.429 172.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.98 104.46 1.13 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.594 1.558 . . . . 0.0 110.698 175.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -102.77 -45.41 5.01 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.589 1.556 . . . . 0.0 110.317 -171.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 125.595 1.558 . . . . 0.0 110.135 -177.132 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtm . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.718 -0.104 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 169.99 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.636 1.574 . . . . 0.0 110.525 -177.348 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 88.62 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.62 1.568 . . . . 0.0 110.468 -174.475 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 52.21 -153.94 0.2 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.558 1.543 . . . . 0.0 111.288 179.503 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 50.83 -171.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.021 2.128 . . . . 0.0 110.221 177.52 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.3 m -140.62 102.74 4.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.602 1.561 . . . . 0.0 110.456 -171.202 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.401 HD22 ' OE1' ' A' ' 11' ' ' GLN . 1.2 mm? -89.68 22.82 2.89 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.348 1.859 . . . . 0.0 110.932 171.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -52.26 178.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.195 1.798 . . . . 0.0 110.814 173.664 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.12 -26.09 42.9 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.398 1.079 . . . . 0.0 110.682 -172.812 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.066 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.819 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 1.066 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.819 HG12 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.525 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.706 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.958 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.512 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.756 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.822 HG21 HG22 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 32' ' ' ARG . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.586 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.641 ' H ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.809 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.644 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.706 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.884 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.884 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.589 ' HB3' HG23 ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.532 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.822 HG22 HG21 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.958 ' HB2' HG21 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.766 ' HA ' HG11 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.809 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.428 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.655 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.57 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.655 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.756 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.445 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.744 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.618 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -69.82 123.2 88.16 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.422 ' HD2' ' NE2' ' A' ' 73' ' ' GLN . 41.0 Cg_exo -38.17 90.04 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 125.201 3.934 . . . . 0.0 114.174 -163.661 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.445 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -136.28 -64.87 0.59 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.316 1.846 . . . . 0.0 111.052 -178.657 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.97 92.71 4.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 110.184 162.612 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.689 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -81.97 -179.69 7.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.227 1.811 . . . . 0.0 111.461 165.233 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.851 HD21 ' HD3' ' A' ' 79' ' ' PRO . 0.0 OUTLIER -23.7 -47.39 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 127.322 2.249 . . . . 0.0 112.184 171.007 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.851 ' HD3' HD21 ' A' ' 78' ' ' ASN . 86.7 Cg_exo -42.76 90.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 125.199 3.933 . . . . 0.0 112.74 176.504 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.47 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 128.528 2.731 . . . . 0.0 113.366 -161.692 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.766 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 156.8 169.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.644 2.377 . . . . 0.0 111.823 -174.724 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.766 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 0.3 OUTLIER -148.15 113.35 5.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.506 1.523 . . . . 0.0 111.278 162.43 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 112.43 1.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.575 1.55 . . . . 0.0 111.139 166.7 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.401 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.9 tt 179.52 139.03 0.11 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.489 1.915 . . . . 0.0 111.934 -173.767 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -72.74 -70.99 0.32 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.674 1.59 . . . . 0.0 111.214 -165.637 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -40.51 100.66 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.127 1.771 . . . . 0.0 110.696 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -96.26 146.97 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.712 1.605 . . . . 0.0 108.972 -170.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.1 p -72.8 -34.14 66.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.59 1.556 . . . . 0.0 110.07 -175.627 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -94.22 70.1 3.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.601 1.56 . . . . 0.0 111.414 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.36 -85.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.557 1.543 . . . . 0.0 110.716 -172.185 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.24 -25.98 29.02 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.585 1.554 . . . . 0.0 110.341 -172.9 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.549 0 C-N-CA 125.583 1.553 . . . . 0.0 110.181 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -125.55 -98.75 0.41 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.615 1.566 . . . . 0.0 110.517 -175.48 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -113.56 107.79 16.28 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.593 1.557 . . . . 0.0 110.506 -170.319 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.474 ' CB ' ' CD2' ' A' ' 7' ' ' LEU . . . -179.79 -78.46 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.883 1.673 . . . . 0.0 111.066 176.34 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 18.3 p 52.54 110.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.414 2.286 . . . . 0.0 110.512 -170.785 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' THR . 29.0 t 95.99 64.57 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 128.379 2.672 . . . . 0.0 109.931 -164.459 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.474 ' CD2' ' CB ' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -89.85 14.67 11.43 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.459 1.904 . . . . 0.0 110.885 -174.091 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 154.39 6.39 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.783 1.233 . . . . 0.0 110.509 -163.584 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.44 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 -72.5 -20.42 61.37 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.026 1.73 . . . . 0.0 111.397 -163.735 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.762 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.526 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . 0.771 ' CZ3' HG12 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.762 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.966 HG21 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.495 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.824 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.776 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.447 ' CE1' ' HG3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 1.002 HG21 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.762 ' HD1' HG21 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.922 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.859 HG21 HG22 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.421 HG22 HG13 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.555 ' H ' HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.774 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.966 ' HA ' HG21 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.495 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.774 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.774 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.859 HG22 HG21 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.526 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG21 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.491 ' HA ' HG11 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.531 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.534 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.846 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.922 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.486 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.477 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 72' ' ' CYS . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.477 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.95 113.47 33.19 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -28.43 84.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.177 1 C-N-CA 126.375 4.717 . . . . 0.0 114.829 -163.101 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -130.63 -61.84 0.94 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.8 2.04 . . . . 0.0 110.878 -175.257 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.05 59.57 0.63 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.007 1.323 . . . . 0.0 109.911 160.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.66 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -90.04 99.61 12.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.88 1.672 . . . . 0.0 111.295 165.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -70.05 93.35 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.658 1.583 . . . . 0.0 110.997 -170.055 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.66 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 89.8 Cg_endo -71.94 -63.54 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.344 3.363 . . . . 0.0 112.688 -166.722 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.465 ' H ' ' HG2' ' A' ' 79' ' ' PRO . 35.6 ttt180 16.06 -116.46 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.555 2.342 . . . . 0.0 111.924 -163.373 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.419 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 6.9 mm100 27.13 -91.34 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.195 2.198 . . . . 0.0 111.746 -173.633 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 170.75 154.08 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.224 1.81 . . . . 0.0 111.32 -177.951 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.9 ptt-85 -110.21 106.56 16.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.471 1.508 . . . . 0.0 111.117 166.132 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.464 HD22 ' HA ' ' A' ' 84' ' ' LEU . 0.2 OUTLIER 179.58 113.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.509 1.923 . . . . 0.0 112.021 -172.497 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -41.22 -57.73 2.02 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.016 1.726 . . . . 0.0 111.325 -177.168 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt 50.99 -169.34 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.593 1.557 . . . . 0.0 110.65 179.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.13 151.28 3.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 125.65 1.58 . . . . 0.0 108.968 -177.599 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.35 135.84 35.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.631 1.573 . . . . 0.0 110.034 178.676 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -139.24 -45.68 0.46 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.584 1.554 . . . . 0.0 111.418 -174.866 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -46.72 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.772 -169.232 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.2 -164.9 0.23 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.527 1.531 . . . . 0.0 110.376 169.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 45.1 ttt85 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.615 1.566 . . . . 0.0 110.151 178.554 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 111.399 0.148 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.89 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.707 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.89 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.447 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.936 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.498 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.625 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.063 HG22 HG23 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.8 HG22 HG12 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.911 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.911 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.849 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.936 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 1.063 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.986 ' HB2' HG22 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.479 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.849 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.479 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.674 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.778 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.625 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.461 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.667 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.534 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.929 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.794 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.929 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.794 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 17' ' ' LEU . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.835 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.835 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.906 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.831 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.637 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.894 HG12 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.894 HG22 HG12 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.912 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.676 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.754 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.863 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.863 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.619 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.831 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.572 ' HE2' HG21 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.915 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.912 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.915 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.637 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.456 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.738 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.443 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.911 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.838 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.911 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.45 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CE1' ' HG2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.99 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.618 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.073 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.841 HG22 HG23 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.661 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.661 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.868 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.868 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.591 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.502 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HB3' ' CG1' ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.841 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.569 ' HE2' HG21 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.548 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.777 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.401 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.591 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.769 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 10.8 m-20 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.888 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.522 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.747 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.888 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.92 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.735 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.735 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.05 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.646 ' CG2' HG23 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.744 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.744 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.848 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.724 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.92 ' HA ' HG22 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.447 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.646 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.05 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.848 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.873 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 1.01 ' HG2' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 1.01 ' CD ' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.535 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.837 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.53 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.675 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.009 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.102 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.738 HG22 HG23 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.737 HG22 HG12 ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.886 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.886 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.846 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.626 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.738 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.102 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' HA ' HG13 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.458 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.451 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.787 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.491 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.029 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.791 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.029 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.791 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.901 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.076 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HD1' HG22 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.847 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.894 HG22 HG23 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.736 HG22 HG12 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.667 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.667 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.865 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.634 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.901 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.783 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.441 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.894 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.076 ' HB2' HG22 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.865 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.535 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.681 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.812 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.498 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.498 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.084 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.708 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.084 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.534 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' A' ' 29' ' ' PHE . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.626 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.465 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.962 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.948 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.726 ' HE2' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.798 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.457 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.911 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.962 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.613 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.757 ' HA ' HG13 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.911 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.719 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.665 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.47 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.798 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.956 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.697 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.956 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.873 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.402 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.842 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.797 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.039 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.68 ' HD1' HG22 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.846 HG22 HG23 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.624 HG22 HG12 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.674 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.685 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.705 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.896 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.873 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.801 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.801 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.578 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.846 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.472 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HB2' HG22 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.639 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.896 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.639 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.686 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.63 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.685 ' HD1' ' C ' ' A' ' 35' ' ' GLY . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.44 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.705 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.614 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 111.333 0.123 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.937 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.937 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.459 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.489 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.015 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.993 HG12 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.993 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.602 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.824 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.738 ' HA ' HG22 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.758 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.758 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.47 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.81 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.015 ' HB2' HG22 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.824 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.637 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.504 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.465 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.788 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.501 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.65 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.788 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.65 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.485 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.861 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.996 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.507 ' HD1' HG22 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.053 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.66 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' HB ' HG23 ' A' ' 34' ' ' THR . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.864 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.671 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.861 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.517 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.488 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.635 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.501 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.053 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' HA ' HG13 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.864 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.466 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.441 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.441 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.613 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.54 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.667 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.896 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.782 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.906 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.474 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.79 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.073 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.767 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.949 HG12 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.949 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.579 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.786 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.886 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.906 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' HIS . . . . . 0.469 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.54 ' NH2' ' HB2' ' A' ' 9' ' ' ASP . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.92 HG23 HG22 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.489 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.585 ' HA ' HG13 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.675 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.786 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.412 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.426 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.561 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.437 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.496 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.969 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.523 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.969 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.477 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.771 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.987 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.605 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.623 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.838 HG22 HG23 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.57 HG22 HG12 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.891 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.891 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.895 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.992 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.992 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.954 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.838 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.987 ' HB2' HG22 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG13 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.895 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.505 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG3' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.702 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.505 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.559 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.623 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.433 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.954 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.955 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.85 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.955 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.732 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.845 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.002 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' HD1' HG22 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.958 HG22 HG23 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.635 HG22 HG12 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.577 HG23 ' N ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.577 ' N ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.905 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.845 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.846 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.846 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.732 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.905 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.732 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.555 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.432 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.41 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.432 ' CG ' ' HB3' ' A' ' 68' ' ' PRO . 7.5 tp60 . . . . . 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.668 0.27 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.848 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.774 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.848 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.579 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.604 ' HD2' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.704 HG22 HG23 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.493 HG23 HG13 ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.493 HG13 HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.838 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.895 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.037 ' HB2' HG22 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.838 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.497 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.625 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.328 0.122 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.711 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.838 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.758 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.651 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.869 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.821 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.042 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.714 ' CG2' HG23 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.491 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.889 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.869 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.821 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.426 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.664 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.445 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.714 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.042 ' HB2' HG22 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.567 ' HA ' HG13 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.889 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.469 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.575 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.664 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.425 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 111.317 0.117 . . . . 0.0 111.317 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.946 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.823 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.946 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.823 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.617 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.658 ' CG1' HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.658 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.859 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.859 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.83 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.856 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.559 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.635 ' H ' ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 48' ' ' LEU . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.5 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.807 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.486 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.83 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.639 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.622 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.408 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.862 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.478 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.489 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.504 0.192 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.686 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.686 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.656 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' O ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.73 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.816 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.997 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.964 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.964 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.752 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.737 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.725 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.997 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.725 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.73 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.474 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.752 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.461 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.779 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.462 ' HB3' HH12 ' A' ' 49' ' ' ARG . 17.4 m-20 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.451 0.167 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.691 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.675 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 2.9 tt0 -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.691 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.849 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.534 ' CD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.612 HG21 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.615 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.653 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.615 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.845 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.849 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.623 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.612 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.469 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.59 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.495 ' C ' HG11 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.755 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.641 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.653 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.456 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.623 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.454 0.168 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.721 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.771 HG22 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.405 ' C ' ' HG2' ' A' ' 19' ' ' ARG . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.405 ' HG2' ' C ' ' A' ' 18' ' ' ALA . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.574 ' N ' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.551 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.742 HG21 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 HG12 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.977 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.771 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.742 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.551 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.511 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.061 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG13 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.886 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.556 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 1.061 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.542 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.97 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.867 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.97 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.714 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.867 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.56 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.689 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.979 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.412 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.912 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.941 HG22 HG23 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.644 HG23 ' HB ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.644 ' HB ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.921 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.586 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.86 ' HA ' HG22 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.787 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.787 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.941 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.921 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.699 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.664 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.82 0.343 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.981 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.446 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.664 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.93 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CD1' HG21 ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.702 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.7 ' CG2' ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.602 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.707 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.707 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.931 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.547 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.981 ' HA ' HG22 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.446 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.821 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.821 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.7 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.641 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.93 ' HB2' HG22 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HA ' HG13 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.931 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.455 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.833 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.702 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.644 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.644 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.434 ' HD3' ' CB ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.527 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 120.455 0.169 . . . . 0.0 111.073 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.024 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.811 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.024 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.772 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 1.028 HG22 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.924 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.557 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.499 HG23 ' H ' ' A' ' 36' ' ' ILE . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.499 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.808 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.924 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 1.028 ' HB3' HG22 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.433 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.723 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.473 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.527 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.596 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.808 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.902 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.723 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.493 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.7 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.447 0.166 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.055 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.809 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.055 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.805 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.73 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.699 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.794 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.995 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.727 HG22 HG23 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.469 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.739 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 1.025 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 1.025 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.672 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.406 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.809 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.739 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.606 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.574 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.583 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.754 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.456 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.686 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.026 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.841 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 1.026 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.841 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.517 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.004 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.8 HG22 HG23 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.595 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.592 HG23 ' N ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.592 ' N ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.772 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.678 ' HD2' ' HG3' ' A' ' 39' ' ' ARG . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.881 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.881 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.567 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.8 HG23 HG22 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.004 ' HB2' HG22 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.794 ' HA ' HG13 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.664 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.747 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.805 0.336 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.784 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TRP . . . . . 0.789 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.784 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.752 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 1.017 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HD1' HG22 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.895 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.843 HG22 HG23 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.418 HG22 HG12 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 HG13 ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.579 HG13 HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.745 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.752 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.892 ' HA ' HG22 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.771 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.771 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.843 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 1.017 ' HB2' HG22 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.497 ' HA ' HG13 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.745 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.524 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.895 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.473 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.509 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtp . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 110.73 -0.1 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -92.17 76.03 5.37 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.56 170.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm 168.24 151.74 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.561 1.545 . . . . 0.0 110.506 -171.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.48 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . 172.87 47.65 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.58 1.552 . . . . 0.0 111.27 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 47.17 -96.13 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.83 1.652 . . . . 0.0 110.106 167.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.38 104.46 6.44 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.541 1.536 . . . . 0.0 110.385 -175.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.48 HD21 ' HB1' ' A' ' 4' ' ' ALA . 2.0 mm? -89.69 22.25 3.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.385 1.874 . . . . 0.0 110.938 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.3 p -53.56 148.12 9.96 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.287 1.835 . . . . 0.0 110.839 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -54.29 -21.67 9.88 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.58 1.552 . . . . 0.0 111.399 174.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.89 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.707 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.89 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.447 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.936 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.498 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.625 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.063 HG22 HG23 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.8 HG22 HG12 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.911 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.911 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.849 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.936 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 1.063 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.986 ' HB2' HG22 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.479 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.849 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.479 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.674 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.778 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.625 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.461 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.667 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.534 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -86.31 -57.02 0.35 Allowed Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 56.9 Cg_endo -79.28 -32.64 1.67 Allowed 'Trans proline' 0 CA--C 1.545 1.049 0 C-N-CA 124.677 3.584 . . . . 0.0 113.319 165.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 75.87 62.3 0.05 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.002 1.721 . . . . 0.0 111.073 -161.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -103.17 45.97 0.94 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.72 1.208 . . . . 0.0 110.242 -167.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.52 130.7 43.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.685 1.594 . . . . 0.0 111.273 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' N ' ' CD ' ' A' ' 79' ' ' PRO . 1.3 p-10 -126.67 34.95 0.27 Allowed Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.522 1.529 . . . . 0.0 111.241 -169.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 78' ' ' ASN . 86.5 Cg_endo -73.57 -88.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.251 3.301 . . . . 0.0 112.55 -166.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.426 ' NE ' ' HA ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -23.19 -70.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 127.663 2.385 . . . . 0.0 112.368 169.692 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 82' ' ' HIS . 2.4 tt0 -15.97 123.28 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.526 2.73 . . . . 0.0 112.685 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.433 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 0.2 OUTLIER -28.52 134.47 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.122 1.769 . . . . 0.0 111.682 164.037 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.441 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.8 OUTLIER -97.35 56.01 1.31 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.571 1.148 . . . . 0.0 110.113 160.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.547 HD22 ' H ' ' A' ' 85' ' ' ASP . 0.1 OUTLIER -42.43 154.29 0.06 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.371 2.269 . . . . 0.0 111.561 -174.52 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.547 ' H ' HD22 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -39.86 -81.76 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.603 1.961 . . . . 0.0 111.693 -164.853 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 167.04 -48.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.414 1.886 . . . . 0.0 110.347 164.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.2 mt -53.25 137.55 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 125.619 1.567 . . . . 0.0 108.98 -165.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 12.3 t -77.22 163.31 26.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.582 1.553 . . . . 0.0 110.068 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.7 m170 59.44 93.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.591 1.556 . . . . 0.0 111.38 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -137.54 77.61 1.64 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.632 1.573 . . . . 0.0 110.731 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.42 -42.78 22.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.552 1.541 . . . . 0.0 110.384 -175.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 110.161 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 120.382 0.134 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.67 12.04 8.66 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.663 1.585 . . . . 0.0 110.714 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt 41.27 67.21 0.56 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.501 1.52 . . . . 0.0 110.454 -167.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 170.94 -56.19 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.838 1.655 . . . . 0.0 111.102 -175.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 m 89.54 -84.45 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.039 1.735 . . . . 0.0 110.267 163.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 m -102.29 48.19 0.88 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.408 1.483 . . . . 0.0 110.665 -163.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.37 23.91 2.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.3 1.84 . . . . 0.0 111.065 168.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.3 157.68 30.6 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.702 2.001 . . . . 0.0 110.769 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -72.01 -33.85 68.4 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.421 1.488 . . . . 0.0 111.413 -170.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.929 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.794 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.929 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.794 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 17' ' ' LEU . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.835 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.835 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.906 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.831 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.637 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.894 HG12 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.894 HG22 HG12 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.912 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.676 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.754 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.863 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.863 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.619 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.831 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.572 ' HE2' HG21 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.915 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.912 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.915 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.637 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.456 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.738 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -49.91 -54.48 32.04 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.6 Cg_endo -92.4 -98.97 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 124.911 3.741 . . . . 0.0 113.123 169.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.3 49.58 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.476 1.911 . . . . 0.0 110.667 169.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' HG2' ' A' ' 74' ' ' PRO . 24.0 mmmt -90.78 37.65 0.93 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.182 1.393 . . . . 0.0 110.739 -161.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.14 152.08 11.27 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.468 1.507 . . . . 0.0 111.206 166.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -145.2 56.31 3.54 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.641 1.576 . . . . 0.0 111.013 -172.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.3 110.94 2.14 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.361 3.374 . . . . 0.0 112.532 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -20.93 -71.21 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.829 2.452 . . . . 0.0 112.39 171.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.527 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 59.21 -177.07 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.77 1.628 . . . . 0.0 110.981 175.12 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.527 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 20.4 t60 -98.02 17.9 17.29 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.558 1.543 . . . . 0.0 111.393 -171.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 48.39 91.73 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.578 1.551 . . . . 0.0 111.157 -170.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 179.5 108.3 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.502 1.921 . . . . 0.0 111.954 -171.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -148.44 -145.3 0.17 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.571 1.548 . . . . 0.0 111.162 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.3 mttm 64.48 -172.67 0.18 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.598 1.559 . . . . 0.0 110.535 167.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.2 tp -124.49 52.93 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.13 1.772 . . . . 0.0 108.956 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.8 p -61.19 171.22 1.39 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.677 1.591 . . . . 0.0 110.037 173.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -63.34 134.04 55.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.613 1.565 . . . . 0.0 111.428 172.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 62.63 -174.21 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.545 1.538 . . . . 0.0 110.759 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.7 m -138.67 40.89 2.19 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.597 1.559 . . . . 0.0 110.36 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.47 0.557 0 C-N-CA 125.621 1.568 . . . . 0.0 110.122 -169.454 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.701 -0.111 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -130.87 27.71 4.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 110.472 172.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.8 mttp -148.02 -169.01 3.23 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.575 1.55 . . . . 0.0 110.502 -169.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 177.65 -156.19 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.562 1.545 . . . . 0.0 111.241 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.7 p -50.18 160.87 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.587 1.555 . . . . 0.0 110.058 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 m -100.51 62.79 1.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.606 1.562 . . . . 0.0 110.387 -172.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.59 19.62 4.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.38 1.872 . . . . 0.0 110.927 172.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 m -58.56 164.85 2.43 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.244 1.818 . . . . 0.0 110.815 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.443 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 -66.1 -28.18 68.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.459 1.503 . . . . 0.0 111.337 -172.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.911 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.838 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.911 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.45 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CE1' ' HG2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.99 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.618 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.073 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.841 HG22 HG23 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.661 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.661 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.868 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.868 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.591 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.502 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HB3' ' CG1' ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.841 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.569 ' HE2' HG21 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.548 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.777 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.415 ' HB2' ' HD3' ' A' ' 74' ' ' PRO . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.591 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.769 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.61 -54.51 0.42 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 76' ' ' LYS . 69.1 Cg_endo -78.64 -22.67 8.98 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.487 3.458 . . . . 0.0 112.729 167.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 68.2 55.75 0.53 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.776 1.63 . . . . 0.0 111.13 -164.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -105.01 36.38 2.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.522 1.129 . . . . 0.0 110.095 -163.11 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.0 168.17 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.667 1.587 . . . . 0.0 111.254 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -154.33 178.43 1.63 Allowed Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.703 1.601 . . . . 0.0 110.899 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.46 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 83.5 Cg_exo -46.72 104.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.277 3.318 . . . . 0.0 112.424 164.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.477 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -38.4 -162.24 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 129.824 3.25 . . . . 0.0 116.897 172.417 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.477 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 4.0 tp-100 5.15 84.5 0.01 OUTLIER 'General case' 0 C--N 1.363 1.167 0 C-N-CA 128.805 2.842 . . . . 0.0 112.589 -165.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.67 -26.23 5.76 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.604 1.562 . . . . 0.0 111.578 167.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 29.71 55.58 0.15 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.893 1.677 . . . . 0.0 110.761 -160.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -38.39 109.78 0.11 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.049 2.14 . . . . 0.0 111.89 -167.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -93.67 164.51 13.12 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.147 1.779 . . . . 0.0 111.422 -170.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 84.17 121.34 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.647 1.579 . . . . 0.0 110.701 163.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm 49.39 81.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.94 1.696 . . . . 0.0 109.003 164.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -61.87 -39.85 93.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.609 1.563 . . . . 0.0 110.074 -172.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -149.85 -83.08 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.585 1.554 . . . . 0.0 111.437 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -119.91 -84.14 0.66 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.594 1.558 . . . . 0.0 110.735 173.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 169.44 135.18 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.591 1.556 . . . . 0.0 110.406 -176.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 125.6 1.56 . . . . 0.0 110.138 176.497 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 110.696 -0.113 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 65.52 63.37 0.63 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.538 1.535 . . . . 0.0 110.561 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -133.97 11.58 3.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.487 1.515 . . . . 0.0 111.004 -178.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.49 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.401 1.48 . . . . 0.0 111.292 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.4 HG23 ' O ' ' A' ' 5' ' ' THR . 13.8 t 30.97 49.94 0.09 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.467 1.907 . . . . 0.0 110.403 -166.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.97 -161.21 1.12 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.625 1.57 . . . . 0.0 110.391 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.411 HD12 ' CZ ' ' A' ' 12' ' ' ARG . 2.2 mm? -89.43 23.3 2.6 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.382 1.873 . . . . 0.0 110.897 165.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.431 HG22 ' H ' ' A' ' 9' ' ' ASP . 3.0 m -59.68 168.43 1.68 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.452 1.901 . . . . 0.0 110.819 175.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' H ' HG22 ' A' ' 8' ' ' THR . 10.8 m-20 -62.33 -23.93 67.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.671 1.589 . . . . 0.0 111.42 -174.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.888 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.522 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.747 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.888 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.92 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.735 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.735 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.05 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.646 ' CG2' HG23 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.744 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.744 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.848 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.724 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.92 ' HA ' HG22 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.447 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.646 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.05 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.848 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.873 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 1.01 ' HG2' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 1.01 ' CD ' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.535 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -57.49 -50.88 85.63 Favored Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 94.7 Cg_endo -94.96 -96.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 125.067 3.845 . . . . 0.0 112.899 170.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 171.95 67.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.066 2.147 . . . . 0.0 110.473 162.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 19.1 mmmt -104.24 27.95 7.29 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.057 1.343 . . . . 0.0 110.4 -161.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.08 129.04 9.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.57 1.548 . . . . 0.0 111.271 168.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -125.66 80.91 65.81 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.631 1.572 . . . . 0.0 110.961 175.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -63.28 119.15 6.1 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 124.242 3.295 . . . . 0.0 112.461 164.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -21.96 -67.71 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.321 2.648 . . . . 0.0 112.732 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.425 ' HG2' ' H ' ' A' ' 83' ' ' ARG . 26.5 tt0 -19.27 131.88 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.813 2.445 . . . . 0.0 112.312 169.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -47.41 -30.46 3.33 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.459 1.504 . . . . 0.0 111.384 165.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.425 ' H ' ' HG2' ' A' ' 81' ' ' GLN . 10.2 tpt180 40.0 65.43 0.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.731 1.612 . . . . 0.0 111.134 -177.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.52 130.07 0.08 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.534 1.934 . . . . 0.0 111.951 -174.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.94 -73.96 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.547 1.539 . . . . 0.0 111.144 169.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 165.03 -52.87 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 110.25 176.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.0 OUTLIER 35.42 86.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 127.46 2.304 . . . . 0.0 109.49 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.9 p -50.86 -25.74 4.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.551 1.54 . . . . 0.0 110.08 -173.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -60.76 138.68 58.08 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.584 1.553 . . . . 0.0 111.448 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.94 27.11 0.62 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 110.683 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.9 m 39.1 35.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.572 1.549 . . . . 0.0 110.381 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.606 1.563 . . . . 0.0 110.136 178.414 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 33.02 84.03 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.648 1.979 . . . . 0.0 110.461 -170.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 75.55 136.8 0.06 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.711 1.604 . . . . 0.0 110.495 167.418 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 170.94 120.05 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.473 1.509 . . . . 0.0 111.413 176.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.664 ' HB ' HD23 ' A' ' 7' ' ' LEU . 6.1 p 51.31 90.57 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.197 1.799 . . . . 0.0 110.235 164.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.99 83.65 0.12 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.701 1.6 . . . . 0.0 110.477 165.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.664 HD23 ' HB ' ' A' ' 5' ' ' THR . 0.3 OUTLIER -89.84 19.79 4.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.449 1.9 . . . . 0.0 110.876 -171.709 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -50.5 145.19 6.79 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.332 1.853 . . . . 0.0 110.942 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 -58.86 -18.41 32.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.711 1.604 . . . . 0.0 111.382 175.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.837 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.53 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.675 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.009 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.102 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.738 HG22 HG23 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.737 HG22 HG12 ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.886 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.886 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.846 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.626 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.738 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.102 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' HA ' HG13 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.458 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.451 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.787 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.491 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -51.1 -48.99 83.77 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 62.9 Cg_endo -81.75 -33.9 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.936 3.758 . . . . 0.0 113.379 165.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.8 t0 78.28 55.72 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.445 1.898 . . . . 0.0 111.032 -163.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 77' ' ' ALA . 6.3 tppt? -110.91 158.78 18.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.401 1.48 . . . . 0.0 110.222 -164.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 76' ' ' LYS . . . -79.73 171.85 14.58 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.597 1.559 . . . . 0.0 111.251 173.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.31 103.57 22.7 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.598 1.559 . . . . 0.0 110.987 172.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.36 -93.66 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 124.209 3.273 . . . . 0.0 112.378 -172.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -18.79 -97.53 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 128.577 2.751 . . . . 0.0 113.136 -173.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -19.79 122.03 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.658 2.383 . . . . 0.0 112.114 166.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.4 p80 -155.17 128.88 8.58 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.225 1.41 . . . . 0.0 111.848 -178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -113.86 51.68 0.85 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.059 1.344 . . . . 0.0 110.186 160.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 85' ' ' ASP . 5.5 tt -41.63 145.74 0.28 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.994 2.117 . . . . 0.0 111.676 -162.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.66 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.1 t0 -121.66 -53.11 2.0 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.386 1.474 . . . . 0.0 111.278 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 tptt 78.69 138.86 0.07 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.53 1.532 . . . . 0.0 110.5 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 pt -146.48 79.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.569 1.548 . . . . 0.0 108.938 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.0 t -67.77 139.87 56.65 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.631 1.572 . . . . 0.0 110.107 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.0 m80 75.19 67.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.628 1.571 . . . . 0.0 111.453 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -44.56 103.99 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.618 1.567 . . . . 0.0 110.696 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.2 m -78.01 103.46 7.97 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.633 1.573 . . . . 0.0 110.368 -170.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.601 1.56 . . . . 0.0 110.134 176.61 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.2 mtt . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.707 -0.109 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.39 34.71 5.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.595 1.558 . . . . 0.0 110.526 175.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 16.7 mmtp -60.95 -88.07 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.647 1.579 . . . . 0.0 110.495 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 160.34 35.62 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.579 1.552 . . . . 0.0 111.236 -166.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -68.04 0.08 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.592 1.557 . . . . 0.0 110.083 -166.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 57.04 97.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.584 1.553 . . . . 0.0 110.394 -177.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.69 21.73 3.37 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.352 1.861 . . . . 0.0 110.852 -170.786 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.0 p -50.7 130.77 25.14 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.134 1.774 . . . . 0.0 110.763 175.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.0 -24.17 57.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 0.0 111.326 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.029 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.791 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.029 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.791 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.901 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.076 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HD1' HG22 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.847 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.894 HG22 HG23 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.736 HG22 HG12 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.667 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.667 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.865 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.634 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.901 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.783 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.441 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.894 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.076 ' HB2' HG22 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.865 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.535 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.681 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.812 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.498 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HG3' ' HB2' ' A' ' 76' ' ' LYS . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.498 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -72.77 125.46 91.17 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -33.34 91.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.076 1 C-N-CA 125.451 4.1 . . . . 0.0 113.768 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -148.6 -70.05 0.22 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.059 1.744 . . . . 0.0 111.156 -172.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.459 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -114.86 77.24 1.05 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.141 1.376 . . . . 0.0 110.021 165.854 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.29 175.48 8.31 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.156 1.782 . . . . 0.0 111.266 164.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.451 ' HA ' ' HD3' ' A' ' 79' ' ' PRO . 0.1 OUTLIER -34.08 135.09 0.36 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 126.829 2.052 . . . . 0.0 111.543 178.121 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 78' ' ' ASN . 32.5 Cg_exo -62.41 113.56 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.748 3.632 . . . . 0.0 112.445 -166.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -21.41 -72.5 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.602 2.361 . . . . 0.0 112.345 168.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 64.31 47.82 3.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.006 1.723 . . . . 0.0 111.13 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 46.48 95.76 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.478 1.911 . . . . 0.0 111.819 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -83.83 55.15 3.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.258 1.023 . . . . 0.0 110.393 161.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.416 ' C ' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -39.71 114.97 0.47 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.029 2.132 . . . . 0.0 111.609 -170.856 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.26 -81.56 0.63 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.609 1.564 . . . . 0.0 111.25 -177.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt 157.16 -179.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.138 1.775 . . . . 0.0 110.44 -164.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.4 mt 64.54 85.52 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.558 1.543 . . . . 0.0 108.978 -165.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.3 p -82.95 100.48 10.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.573 1.549 . . . . 0.0 110.092 -164.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.5 m170 50.04 33.18 6.53 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.623 1.569 . . . . 0.0 111.457 165.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.83 -175.65 5.54 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.585 1.554 . . . . 0.0 110.744 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 28.7 m -117.04 -28.77 6.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.678 1.591 . . . . 0.0 110.382 171.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 125.634 1.574 . . . . 0.0 110.17 170.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtp . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.738 -0.097 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -129.23 133.29 47.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.614 1.566 . . . . 0.0 110.497 -174.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -102.67 -170.61 1.83 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.566 1.546 . . . . 0.0 110.466 167.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.03 92.92 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.614 1.566 . . . . 0.0 111.249 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.72 140.25 37.86 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.554 1.542 . . . . 0.0 110.055 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.871 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.7 OUTLIER -94.28 166.85 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.552 1.541 . . . . 0.0 110.307 166.435 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -89.67 20.52 3.98 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.386 1.874 . . . . 0.0 110.847 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.871 HG23 ' HB3' ' A' ' 6' ' ' CYS . 49.7 p -51.68 134.04 30.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.092 1.757 . . . . 0.0 110.851 -177.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 -59.15 -17.92 31.37 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.413 1.485 . . . . 0.0 111.388 -173.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.084 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.708 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.084 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.534 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' A' ' 29' ' ' PHE . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.626 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.465 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.962 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.948 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.726 ' HE2' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.798 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.457 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.911 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.962 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.613 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.757 ' HA ' HG13 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.911 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.719 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.665 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.47 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.798 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -75.8 107.38 4.21 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -32.58 88.21 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.239 4.626 . . . . 0.0 114.307 -163.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 42.1 t0 -129.86 -62.63 0.95 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.394 1.878 . . . . 0.0 111.098 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.2 tppt? -135.65 131.76 36.17 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.044 1.338 . . . . 0.0 110.383 163.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.93 170.18 12.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.637 1.575 . . . . 0.0 111.264 166.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -61.41 120.57 56.66 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.729 1.612 . . . . 0.0 111.007 -176.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -72.59 150.01 50.37 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.372 3.381 . . . . 0.0 112.724 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.406 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 8.0 ttm180 24.72 -106.63 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.312 2.245 . . . . 0.0 112.139 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.406 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 4.8 tt0 66.26 85.3 0.14 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.908 1.683 . . . . 0.0 110.974 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.51 -43.98 1.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.611 1.564 . . . . 0.0 111.365 164.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.0 mtm-85 37.65 76.17 0.06 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.651 1.58 . . . . 0.0 111.087 -169.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 tt 179.51 114.63 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.521 1.928 . . . . 0.0 111.939 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.02 -52.33 36.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.665 1.586 . . . . 0.0 111.212 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 166.48 126.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.039 1.736 . . . . 0.0 110.452 -169.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.9 tt -65.52 131.44 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.624 1.57 . . . . 0.0 108.965 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.0 p -84.73 173.06 10.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.596 1.559 . . . . 0.0 110.048 -175.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 78.4 m80 60.34 30.28 19.69 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.625 1.57 . . . . 0.0 111.43 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -88.56 -169.71 2.65 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.591 1.556 . . . . 0.0 110.676 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 t -95.23 -45.95 6.96 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.578 1.551 . . . . 0.0 110.337 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.579 1.552 . . . . 0.0 110.166 171.642 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 110.703 -0.11 . . . . 0.0 110.703 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -128.66 172.47 11.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.57 1.548 . . . . 0.0 110.503 -172.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -71.37 151.39 44.14 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.612 1.565 . . . . 0.0 110.5 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.602 ' C ' HG22 ' A' ' 5' ' ' THR . . . 71.39 152.44 0.11 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.6 1.56 . . . . 0.0 111.249 170.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.602 HG22 ' C ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 168.49 136.4 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.583 1.553 . . . . 0.0 110.057 -172.609 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t 76.59 48.03 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.601 1.56 . . . . 0.0 110.37 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.82 HD12 HH21 ' A' ' 12' ' ' ARG . 2.0 mm? -89.67 18.99 4.94 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.449 1.899 . . . . 0.0 110.901 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 53.2 p -48.65 151.98 1.06 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.23 1.812 . . . . 0.0 110.848 -173.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 -57.42 -16.92 10.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.523 1.529 . . . . 0.0 111.349 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.956 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.82 HH21 HD12 ' A' ' 7' ' ' LEU . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.697 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.956 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.873 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.842 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.797 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.039 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.68 ' HD1' HG22 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.846 HG22 HG23 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.624 HG22 HG12 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.674 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.685 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.705 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.896 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.873 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.801 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.801 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.578 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.846 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.472 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HB2' HG22 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.639 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.896 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.639 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.686 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.63 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.685 ' HD1' ' C ' ' A' ' 35' ' ' GLY . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.44 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.705 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.614 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -72.53 -52.11 6.77 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.7 Cg_endo -87.43 -29.17 0.39 Allowed 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.592 3.528 . . . . 0.0 113.631 172.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.76 56.1 0.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.716 1.606 . . . . 0.0 111.052 -162.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.464 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -100.28 26.91 6.08 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.221 1.409 . . . . 0.0 110.569 -162.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.16 84.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.539 1.535 . . . . 0.0 111.351 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 t30 162.21 93.82 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 110.917 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 -107.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.13 3.22 . . . . 0.0 112.248 -166.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -30.09 -72.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.601 2.36 . . . . 0.0 112.799 -162.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -27.55 143.67 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.609 2.364 . . . . 0.0 112.356 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -107.79 -46.14 3.86 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.217 1.407 . . . . 0.0 111.706 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 21.68 59.87 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.778 2.031 . . . . 0.0 111.211 -160.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.936 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.5 OUTLIER -34.33 140.9 0.06 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.351 2.26 . . . . 0.0 111.731 -177.277 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.936 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -121.63 147.08 46.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.502 1.521 . . . . 0.0 111.285 172.507 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.31 -76.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.694 1.998 . . . . 0.0 110.294 -171.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.8 mm 65.03 97.12 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.616 1.566 . . . . 0.0 108.997 -177.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 t -61.05 154.49 22.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.584 1.554 . . . . 0.0 110.085 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -61.82 116.64 5.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.566 1.546 . . . . 0.0 111.44 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.93 71.5 0.47 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.61 1.564 . . . . 0.0 110.731 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -50.6 7.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.626 1.57 . . . . 0.0 110.358 -174.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.589 1.555 . . . . 0.0 110.155 -173.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mtp . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -126.27 63.08 1.26 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.581 1.552 . . . . 0.0 110.512 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.3 OUTLIER -77.66 -42.41 34.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.601 1.56 . . . . 0.0 110.532 179.151 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 81.12 120.06 0.05 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.631 1.572 . . . . 0.0 111.26 172.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -127.61 101.7 6.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.015 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.53 ' SG ' HG23 ' A' ' 8' ' ' THR . 6.7 t 78.12 140.06 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.621 1.569 . . . . 0.0 110.402 175.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.467 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.65 19.14 4.83 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.385 1.874 . . . . 0.0 110.914 -170.218 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.53 HG23 ' SG ' ' A' ' 6' ' ' CYS . 31.3 p -45.59 128.69 8.5 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.173 1.789 . . . . 0.0 110.809 -174.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 -64.35 -18.22 64.44 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.455 1.502 . . . . 0.0 111.333 -169.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.937 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.467 ' NH1' HD13 ' A' ' 7' ' ' LEU . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.937 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.459 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.489 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.015 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.993 HG12 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.993 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.602 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.824 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.738 ' HA ' HG22 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.758 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.758 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.47 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.81 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.015 ' HB2' HG22 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.824 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.637 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.504 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.465 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.427 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.47 -53.18 0.46 Allowed Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.495 ' HG2' ' CE ' ' A' ' 76' ' ' LYS . 4.1 Cg_endo -79.95 -26.66 4.31 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 125.009 3.806 . . . . 0.0 112.897 168.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.6 t0 65.51 56.57 0.94 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.58 1.552 . . . . 0.0 111.182 -163.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.495 ' CE ' ' HG2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -107.4 40.97 1.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.856 1.262 . . . . 0.0 110.434 -163.218 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.459 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -66.67 96.5 0.4 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.508 1.523 . . . . 0.0 111.25 -177.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -52.74 100.83 0.24 Allowed Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.732 1.613 . . . . 0.0 110.97 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.594 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 74.6 Cg_exo -54.08 -62.36 0.32 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 124.331 3.354 . . . . 0.0 112.642 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.642 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -22.15 -73.8 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.424 2.69 . . . . 0.0 112.708 -174.329 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 0.4 OUTLIER 40.17 86.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.78 1.632 . . . . 0.0 110.916 -172.082 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -172.08 3.94 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.649 1.58 . . . . 0.0 111.382 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -120.85 94.63 4.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.636 1.575 . . . . 0.0 111.138 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 84' ' ' LEU . 0.4 OUTLIER 179.55 53.01 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.518 1.927 . . . . 0.0 112.004 -171.436 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.46 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.155 1.782 . . . . 0.0 111.159 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 61.89 141.21 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.147 1.779 . . . . 0.0 110.61 -171.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 pt -112.38 -178.64 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 126.14 1.776 . . . . 0.0 108.995 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.5 p -63.13 170.43 2.85 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.619 1.568 . . . . 0.0 110.013 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -43.94 126.08 4.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.585 1.554 . . . . 0.0 111.409 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -165.77 154.97 11.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.619 1.567 . . . . 0.0 110.727 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 12.9 t -65.49 -35.16 80.07 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.613 1.565 . . . . 0.0 110.338 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.585 1.554 . . . . 0.0 110.162 172.434 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 CA--C 1.545 0.756 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttt 50.12 -157.06 0.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.625 1.57 . . . . 0.0 110.536 -175.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -110.47 141.1 44.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.625 1.57 . . . . 0.0 110.49 -174.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.743 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . -45.77 153.75 0.26 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.628 1.571 . . . . 0.0 111.277 169.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.9 t -143.37 158.5 43.59 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.561 1.544 . . . . 0.0 110.067 167.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 m 60.45 53.65 4.14 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.592 1.557 . . . . 0.0 110.401 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.827 HD13 HH21 ' A' ' 12' ' ' ARG . 0.1 OUTLIER -89.63 19.8 4.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.353 1.861 . . . . 0.0 110.933 178.834 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.0 p -57.89 133.92 55.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.366 1.866 . . . . 0.0 110.816 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.72 -21.68 60.14 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.673 1.589 . . . . 0.0 111.401 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.788 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.827 HH21 HD13 ' A' ' 7' ' ' LEU . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.65 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.788 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.65 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.861 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.996 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.507 ' HD1' HG22 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.053 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.66 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' HB ' HG23 ' A' ' 34' ' ' THR . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.864 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.671 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.861 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.517 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.488 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.635 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.501 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.053 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' HA ' HG13 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.864 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.466 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.441 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.441 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.613 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.34 147.11 95.03 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.31 92.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.861 3.707 . . . . 0.0 113.337 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 -66.35 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.602 1.561 . . . . 0.0 111.198 -174.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -130.78 55.34 1.84 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.117 1.367 . . . . 0.0 110.276 164.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.25 134.83 34.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.572 1.549 . . . . 0.0 111.257 164.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 55.72 69.82 1.77 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.639 1.575 . . . . 0.0 111.049 176.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.409 ' HG2' ' H ' ' A' ' 80' ' ' ARG . 68.2 Cg_endo -68.79 -87.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.175 0 C-N-CA 124.326 3.35 . . . . 0.0 112.665 -170.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' H ' ' HG2' ' A' ' 79' ' ' PRO . 7.0 ttp180 -21.08 -67.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.39 2.676 . . . . 0.0 112.982 -173.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -16.33 109.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.091 2.556 . . . . 0.0 112.369 171.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -94.82 -54.64 3.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.366 1.467 . . . . 0.0 111.341 -164.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.404 ' O ' HD22 ' A' ' 84' ' ' LEU . 8.3 mtm180 47.15 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.165 1.386 . . . . 0.0 110.775 -162.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.408 ' HA ' HD13 ' A' ' 84' ' ' LEU . 0.1 OUTLIER 179.47 152.65 0.41 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.485 1.914 . . . . 0.0 111.99 -167.642 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -62.51 -75.44 0.07 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.109 1.764 . . . . 0.0 111.208 177.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.25 161.92 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.261 1.825 . . . . 0.0 110.54 -171.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -84.62 88.94 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 109.024 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.41 HG22 ' N ' ' A' ' 89' ' ' HIS . 21.6 m -52.93 -87.71 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.593 1.557 . . . . 0.0 110.076 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.41 ' N ' HG22 ' A' ' 88' ' ' THR . 3.9 p-80 -100.37 -6.53 25.62 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.684 1.593 . . . . 0.0 111.826 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 65.64 -164.51 0.24 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.306 1.442 . . . . 0.0 110.686 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 p -99.37 178.57 4.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.575 1.55 . . . . 0.0 110.367 177.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 110.12 -173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ttt . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 110.732 -0.099 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -124.75 -84.8 0.64 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.569 1.548 . . . . 0.0 110.532 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 10.1 mttt -86.98 97.79 10.9 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.606 1.562 . . . . 0.0 110.508 -170.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 164.94 -46.07 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.595 1.558 . . . . 0.0 111.247 -170.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 m -128.78 87.42 2.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.61 1.564 . . . . 0.0 110.068 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.1 OUTLIER -179.43 161.39 1.06 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.607 1.563 . . . . 0.0 110.374 -171.639 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -89.68 21.58 3.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.381 1.872 . . . . 0.0 110.901 -173.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.723 HG23 ' HB3' ' A' ' 6' ' ' CYS . 30.2 p -48.52 146.4 2.99 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.23 1.812 . . . . 0.0 110.787 178.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.54 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 -63.55 -27.35 69.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.653 1.581 . . . . 0.0 111.401 -170.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.667 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.896 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.782 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.906 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.474 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.79 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.073 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.767 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.949 HG12 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.949 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.579 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.786 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.886 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.906 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.469 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.54 ' NH2' ' HB2' ' A' ' 9' ' ' ASP . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.92 HG23 HG22 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.489 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.585 ' HA ' HG13 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.675 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.786 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.412 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.426 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.561 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.437 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.496 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -60.13 -52.23 74.83 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.477 ' CG ' ' HG3' ' A' ' 76' ' ' LYS . 62.2 Cg_endo -89.27 -26.25 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 125.071 3.847 . . . . 0.0 113.415 174.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.1 t70 72.52 59.43 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.865 1.666 . . . . 0.0 111.241 -164.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.477 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 2.8 mtmt -103.32 45.57 0.95 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.148 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.23 130.48 35.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.601 1.56 . . . . 0.0 111.338 170.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -59.43 106.94 0.82 Allowed Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.608 1.563 . . . . 0.0 111.017 -174.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.12 -11.21 25.09 Favored 'Trans proline' 0 CA--C 1.548 1.177 0 C-N-CA 124.426 3.417 . . . . 0.0 113.095 -169.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -16.99 -88.31 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 128.298 2.639 . . . . 0.0 113.242 -163.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -15.47 109.21 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.458 2.703 . . . . 0.0 112.614 177.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 56.86 118.05 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.729 1.611 . . . . 0.0 111.401 -163.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -100.51 58.19 0.94 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.62 1.168 . . . . 0.0 110.467 161.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.811 HD22 ' H ' ' A' ' 85' ' ' ASP . 2.9 tm? -37.28 142.01 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.063 2.145 . . . . 0.0 111.366 -177.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.811 ' H ' HD22 ' A' ' 84' ' ' LEU . 10.4 t70 -45.35 -71.97 0.07 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.497 1.519 . . . . 0.0 111.2 -170.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.537 ' HB3' HD12 ' A' ' 87' ' ' ILE . 0.5 OUTLIER 166.18 -168.6 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.459 1.904 . . . . 0.0 110.682 168.682 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 86' ' ' LYS . 1.7 mp 72.48 153.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.884 1.674 . . . . 0.0 109.001 165.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 m -78.97 -59.02 2.95 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.616 1.566 . . . . 0.0 110.099 175.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.3 t60 55.03 95.41 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.585 1.554 . . . . 0.0 111.387 -173.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.22 -72.24 0.26 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.599 1.56 . . . . 0.0 110.726 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.7 p -165.41 141.38 5.33 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 110.377 -178.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.619 1.568 . . . . 0.0 110.167 -174.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.4 -153.57 0.27 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.673 1.589 . . . . 0.0 110.526 -166.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER 83.41 124.4 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.581 1.552 . . . . 0.0 110.525 172.441 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.21 -19.12 0.43 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 111.495 175.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.83 -27.04 12.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.522 1.529 . . . . 0.0 110.063 -168.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 m 45.85 54.86 7.5 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.563 1.545 . . . . 0.0 110.361 -174.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.3 OUTLIER -89.66 19.65 4.52 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.427 1.891 . . . . 0.0 110.926 -169.319 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.6 p -51.74 124.77 13.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.835 1.654 . . . . 0.0 110.775 -175.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -72.72 -22.09 60.94 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.518 1.527 . . . . 0.0 111.309 -165.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.969 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.523 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.969 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.477 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.771 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.987 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.605 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.623 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.838 HG22 HG23 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.57 HG22 HG12 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.891 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.891 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.895 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.992 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.992 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.954 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.838 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.987 ' HB2' HG22 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG13 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.895 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.505 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG3' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.702 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.505 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.559 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.623 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.433 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.954 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -87.56 162.03 43.49 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -39.63 90.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.06 1 C-N-CA 125.438 4.092 . . . . 0.0 113.954 -163.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.7 t0 -169.21 -72.12 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.518 1.527 . . . . 0.0 111.228 -174.052 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.74 124.82 30.6 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.991 1.316 . . . . 0.0 110.266 167.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.92 140.06 16.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.729 1.612 . . . . 0.0 111.267 -171.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -95.92 163.72 20.42 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.506 1.523 . . . . 0.0 110.922 -175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.67 149.92 1.74 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.268 3.312 . . . . 0.0 112.465 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 2.0 ttt-85 24.64 -105.51 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.946 2.099 . . . . 0.0 112.05 -168.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 4.4 mt-30 160.39 151.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.845 2.458 . . . . 0.0 111.802 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.62 -25.58 11.27 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.792 1.637 . . . . 0.0 111.473 -175.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 32.25 55.51 0.35 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.39 1.476 . . . . 0.0 110.5 -161.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.808 HD22 ' N ' ' A' ' 85' ' ' ASP . 1.3 tm? -33.86 129.2 0.34 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.395 2.278 . . . . 0.0 112.254 -162.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.808 ' N ' HD22 ' A' ' 84' ' ' LEU . 4.1 p-10 -63.37 -142.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.391 1.876 . . . . 0.0 111.305 175.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 169.03 -39.2 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 0.0 110.513 165.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 41.52 79.63 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 126.189 1.796 . . . . 0.0 109.026 -178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -63.99 140.95 58.92 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.562 1.545 . . . . 0.0 110.025 -166.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -146.41 127.35 14.52 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.618 1.567 . . . . 0.0 111.452 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.98 157.87 36.68 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.755 -176.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.22 156.02 36.22 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.634 1.574 . . . . 0.0 110.375 -176.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 125.595 1.558 . . . . 0.0 110.123 -171.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 110.715 -0.106 . . . . 0.0 110.715 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -111.88 29.81 7.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.612 1.565 . . . . 0.0 110.502 -170.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 1.1 ttpt -172.21 -147.72 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.596 1.558 . . . . 0.0 110.518 -173.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.12 -89.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.607 1.563 . . . . 0.0 111.251 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 41.21 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.584 1.554 . . . . 0.0 110.062 -173.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 87.04 4.03 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.542 1.537 . . . . 0.0 110.35 -176.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.562 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.64 17.9 6.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.433 1.893 . . . . 0.0 110.918 173.328 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.1 p -48.03 125.96 9.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.167 1.787 . . . . 0.0 110.767 -171.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -60.82 -34.92 75.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.838 1.655 . . . . 0.0 111.436 -170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.955 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.562 ' NH1' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.85 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.955 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.732 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.845 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.002 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' HD1' HG22 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.958 HG22 HG23 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.635 HG22 HG12 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.577 HG23 ' N ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.577 ' N ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.905 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.845 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.846 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.846 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.732 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.905 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.732 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.555 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.432 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.41 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.432 ' CG ' ' HB3' ' A' ' 68' ' ' PRO . 7.5 tp60 -55.61 111.44 3.11 Favored Pre-proline 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -25.21 81.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.121 1 C-N-CA 126.597 4.865 . . . . 0.0 115.169 -162.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.1 t0 67.19 63.8 0.44 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.726 2.01 . . . . 0.0 111.263 172.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -90.87 25.64 2.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.029 1.332 . . . . 0.0 110.378 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.42 165.25 16.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.612 1.565 . . . . 0.0 111.273 -167.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -115.18 134.5 22.54 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.625 1.57 . . . . 0.0 110.988 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.41 97.87 0.72 Allowed 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 124.39 3.393 . . . . 0.0 112.565 170.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -20.74 -70.03 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.72 2.408 . . . . 0.0 112.399 170.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 44.8 40.04 3.96 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.868 1.667 . . . . 0.0 111.0 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.85 124.24 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.56 1.544 . . . . 0.0 111.387 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.91 99.8 0.14 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.653 1.581 . . . . 0.0 111.114 165.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.668 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.3 tt 179.54 122.2 0.06 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.379 1.872 . . . . 0.0 111.911 -173.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.668 ' N ' HD23 ' A' ' 84' ' ' LEU . 14.5 t0 27.8 -86.02 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 128.132 2.573 . . . . 0.0 112.368 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 163.59 151.06 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.657 1.583 . . . . 0.0 110.586 -168.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 46.2 mm -80.48 90.17 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.698 1.599 . . . . 0.0 109.0 -171.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -73.78 166.19 23.76 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.609 1.564 . . . . 0.0 110.041 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 71.47 169.08 0.32 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.644 1.577 . . . . 0.0 111.394 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -123.12 168.9 11.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.612 1.565 . . . . 0.0 110.699 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -84.29 123.61 30.35 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.619 1.568 . . . . 0.0 110.385 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.607 1.563 . . . . 0.0 110.186 -178.978 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.725 -0.102 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -55.77 -26.64 46.88 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.63 1.572 . . . . 0.0 110.515 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.432 ' HG2' ' N ' ' A' ' 4' ' ' ALA . 12.1 ttmm -85.25 155.17 21.51 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.604 1.562 . . . . 0.0 110.5 -175.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.432 ' N ' ' HG2' ' A' ' 3' ' ' LYS . . . -47.94 114.69 0.97 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.6 1.56 . . . . 0.0 111.246 178.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 70.55 164.07 0.26 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.591 1.556 . . . . 0.0 110.049 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 11' ' ' GLN . 38.6 m -93.1 73.53 4.68 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 110.386 -168.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.87 21.79 3.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.339 1.856 . . . . 0.0 110.915 -168.864 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 79.4 p -48.67 167.69 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.285 1.834 . . . . 0.0 110.851 176.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -68.25 -24.27 64.88 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.804 1.641 . . . . 0.0 111.339 -173.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.848 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.774 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.848 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.579 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.604 ' HD2' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.704 HG22 HG23 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.493 HG23 HG13 ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.493 HG13 HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.838 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.895 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.037 ' HB2' HG22 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.838 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.497 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.625 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 68' ' ' PRO . 1.6 tm0? -68.43 115.11 26.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -40.32 91.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 1 C-N-CA 125.668 4.246 . . . . 0.0 113.433 -163.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -134.45 -60.78 0.79 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.272 1.829 . . . . 0.0 111.153 174.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.7 tttt -129.67 38.26 3.87 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.334 1.454 . . . . 0.0 110.346 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' O ' ' A' ' 71' ' ' ARG . . . -89.16 117.28 28.03 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.543 1.537 . . . . 0.0 111.212 164.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 72.37 119.14 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.656 1.582 . . . . 0.0 111.034 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -71.31 136.51 29.11 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.368 3.378 . . . . 0.0 112.625 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -18.0 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.935 2.494 . . . . 0.0 112.763 168.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 159.8 -52.85 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 127.668 2.387 . . . . 0.0 111.884 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 p80 43.32 85.91 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.004 1.722 . . . . 0.0 111.51 169.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -53.67 112.71 0.98 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.597 1.559 . . . . 0.0 111.13 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.631 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.3 OUTLIER 179.48 134.48 0.1 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.49 1.916 . . . . 0.0 111.904 -171.356 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.631 ' H ' HD23 ' A' ' 84' ' ' LEU . 3.0 t0 -151.07 -142.24 0.12 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.764 1.626 . . . . 0.0 111.089 -166.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER 90.16 -10.21 0.34 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.737 . . . . 0.0 110.802 163.726 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.47 HG23 ' HE3' ' A' ' 86' ' ' LYS . 0.4 OUTLIER -115.53 169.91 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.038 1.735 . . . . 0.0 108.953 165.037 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.5 p -69.38 -36.19 76.57 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.74 1.616 . . . . 0.0 110.028 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 83.33 23.57 0.14 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.62 1.568 . . . . 0.0 111.445 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.06 131.57 43.05 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.598 1.559 . . . . 0.0 110.695 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -158.44 145.07 17.41 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.626 1.57 . . . . 0.0 110.384 173.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 . . . . . 0 N--CA 1.469 0.52 0 C-N-CA 125.559 1.543 . . . . 0.0 110.139 173.352 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ptp . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.78 -98.13 0.12 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.652 1.581 . . . . 0.0 110.483 -178.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 38.41 49.37 1.35 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.602 1.561 . . . . 0.0 110.535 -170.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 45.17 80.92 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.595 1.558 . . . . 0.0 111.256 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.817 ' CG2' HD23 ' A' ' 7' ' ' LEU . 2.1 m -157.32 126.39 5.87 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.584 1.553 . . . . 0.0 110.011 -176.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 m -102.74 70.25 1.11 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.601 1.56 . . . . 0.0 110.379 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.817 HD23 ' CG2' ' A' ' 5' ' ' THR . 0.5 OUTLIER -89.43 24.99 2.07 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.344 1.858 . . . . 0.0 110.91 -171.694 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 m -58.11 165.72 1.82 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.486 1.914 . . . . 0.0 110.749 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 -65.65 -16.57 63.86 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.467 1.507 . . . . 0.0 111.328 -171.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.445 HH21 HD12 ' A' ' 7' ' ' LEU . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.711 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.838 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.758 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.651 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.869 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.821 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.042 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.714 ' CG2' HG23 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.491 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.889 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.869 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.821 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.426 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.664 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.445 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.714 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.042 ' HB2' HG22 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.567 ' HA ' HG13 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.889 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.469 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.575 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.664 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.435 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -59.46 -52.56 73.38 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 59.2 Cg_endo -88.11 -32.83 0.14 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.9 3.734 . . . . 0.0 113.411 171.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 t0 75.25 60.61 0.06 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.146 1.778 . . . . 0.0 111.139 -163.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -113.51 30.57 7.13 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.556 1.542 . . . . 0.0 110.248 -172.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.21 150.97 24.44 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.604 1.562 . . . . 0.0 111.224 166.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.07 117.84 68.52 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.612 1.565 . . . . 0.0 110.99 -172.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -46.96 -55.29 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.283 3.322 . . . . 0.0 112.49 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -14.76 -88.09 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.683 2.393 . . . . 0.0 112.653 163.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 72.97 51.97 0.14 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.098 1.759 . . . . 0.0 111.013 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.0 129.29 0.07 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.029 1.731 . . . . 0.0 111.391 164.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 54.74 3.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.805 1.242 . . . . 0.0 110.47 161.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.671 HD22 ' O ' ' A' ' 86' ' ' LYS . 2.5 tt -36.02 114.73 0.29 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.242 2.217 . . . . 0.0 112.167 -162.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.98 -69.08 0.35 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.525 1.53 . . . . 0.0 111.226 -177.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.671 ' O ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -38.7 155.86 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.745 1.618 . . . . 0.0 110.566 170.942 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.0 122.77 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.536 1.534 . . . . 0.0 108.963 171.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -70.11 -84.04 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.641 1.576 . . . . 0.0 110.086 -173.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 76.32 129.06 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.58 1.552 . . . . 0.0 111.396 167.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 57.96 95.8 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.519 1.528 . . . . 0.0 110.712 172.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.56 84.33 0.18 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.618 1.567 . . . . 0.0 110.388 170.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.617 1.567 . . . . 0.0 110.142 -173.433 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.712 -0.107 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.7 28.54 5.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.584 1.554 . . . . 0.0 110.491 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 2.4 ttpt -167.49 145.79 4.76 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.63 1.572 . . . . 0.0 110.551 -172.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 80.69 151.67 0.11 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.585 1.554 . . . . 0.0 111.256 174.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -157.38 -44.68 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.724 1.61 . . . . 0.0 110.029 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.7 p 33.3 89.36 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.681 2.392 . . . . 0.0 111.151 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 21.43 3.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.361 1.864 . . . . 0.0 110.921 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -52.84 172.45 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.106 1.762 . . . . 0.0 110.774 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -80.0 -28.08 39.48 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.361 1.464 . . . . 0.0 111.317 -169.395 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.946 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.823 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.946 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.823 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.617 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.658 ' CG1' HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.658 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.859 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.859 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.83 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.856 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.559 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.635 ' H ' ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 48' ' ' LEU . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.5 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.807 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.486 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.83 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.639 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.622 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.408 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.862 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.478 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.489 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -74.32 133.08 78.12 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.66 93.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.428 3.419 . . . . 0.0 113.109 -171.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -142.91 -74.62 0.28 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.601 1.56 . . . . 0.0 111.202 -178.202 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -129.47 71.47 1.44 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.938 1.295 . . . . 0.0 110.231 168.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.55 174.68 11.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.848 1.659 . . . . 0.0 111.254 169.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.42 ' CG ' ' HD2' ' A' ' 79' ' ' PRO . 23.6 t30 85.82 142.84 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.775 1.63 . . . . 0.0 110.947 166.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 78' ' ' ASN . 71.9 Cg_endo -70.69 157.0 59.83 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.402 3.401 . . . . 0.0 112.585 -166.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 1.8 ttt180 24.7 -105.58 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.238 2.215 . . . . 0.0 112.128 -171.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.402 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER 47.67 62.55 2.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.822 1.649 . . . . 0.0 110.994 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -90.58 -26.31 19.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.667 1.587 . . . . 0.0 111.434 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 71.22 81.65 0.15 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.584 1.554 . . . . 0.0 111.132 -170.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 179.48 107.64 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.504 1.921 . . . . 0.0 111.939 -176.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.49 -60.84 1.76 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.61 1.564 . . . . 0.0 111.187 -171.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.88 38.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.581 1.552 . . . . 0.0 110.499 170.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.32 73.73 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.553 1.541 . . . . 0.0 108.932 169.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.1 p -58.72 163.27 3.4 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.593 1.557 . . . . 0.0 110.079 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -90.95 90.9 8.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.655 1.582 . . . . 0.0 111.397 -171.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.87 -75.12 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.564 1.546 . . . . 0.0 110.742 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 24.8 t -73.64 153.68 40.05 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.574 1.549 . . . . 0.0 110.371 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 125.555 1.542 . . . . 0.0 110.15 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 120.3 0.095 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt 48.91 56.79 7.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.61 1.564 . . . . 0.0 110.497 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -88.07 -29.94 20.27 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.605 1.562 . . . . 0.0 110.484 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 50.78 -92.43 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.61 1.564 . . . . 0.0 111.254 171.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -94.86 133.85 38.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.589 1.555 . . . . 0.0 110.057 -165.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 m -98.58 111.86 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.644 1.578 . . . . 0.0 110.41 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.778 HD12 ' NH1' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -89.61 23.33 2.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.398 1.879 . . . . 0.0 110.891 -179.094 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 9' ' ' ASP . 3.2 m -52.98 172.73 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.275 1.83 . . . . 0.0 110.817 173.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 8' ' ' THR . 1.9 p30 -62.72 -27.26 69.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.611 1.564 . . . . 0.0 111.384 -178.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.778 ' NH1' HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.686 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.686 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.656 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' O ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.73 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.816 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.997 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.964 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.964 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.752 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.737 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.725 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.997 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.725 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.73 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.474 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.752 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.461 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.779 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -72.99 128.46 87.9 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -34.78 90.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.065 1 C-N-CA 126.071 4.514 . . . . 0.0 113.975 -174.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -150.33 -79.23 0.13 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.804 1.642 . . . . 0.0 111.216 -169.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.16 64.1 1.1 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.287 1.435 . . . . 0.0 110.357 -178.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' ARG . . . -81.65 120.21 24.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.426 1.491 . . . . 0.0 111.258 164.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.418 ' OD1' ' HD2' ' A' ' 79' ' ' PRO . 27.8 t30 -167.2 138.55 2.59 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.485 1.514 . . . . 0.0 110.998 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.418 ' HD2' ' OD1' ' A' ' 78' ' ' ASN . 64.6 Cg_endo -81.33 47.54 2.58 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.57 3.513 . . . . 0.0 113.037 172.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.5 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.789 2.436 . . . . 0.0 112.482 170.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 48.05 -94.55 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.789 1.636 . . . . 0.0 111.022 178.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -57.02 153.28 11.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.587 1.555 . . . . 0.0 111.469 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.98 60.56 5.52 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.025 1.33 . . . . 0.0 110.429 161.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.77 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -44.96 165.33 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.597 2.359 . . . . 0.0 113.108 -172.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -133.06 -65.26 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 125.511 1.524 . . . . 0.0 111.223 -171.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt 64.35 27.23 13.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 0.0 110.571 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -140.91 128.85 23.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 125.63 1.572 . . . . 0.0 108.996 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.8 m -87.57 -61.97 1.6 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.601 1.56 . . . . 0.0 110.054 -174.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.446 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -95.2 59.22 2.21 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.655 1.582 . . . . 0.0 111.415 -170.645 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 89' ' ' HIS . . . 82.58 120.97 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.587 1.555 . . . . 0.0 110.713 170.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 8.2 p -91.0 -26.46 19.2 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.637 1.575 . . . . 0.0 110.412 176.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.625 1.57 . . . . 0.0 110.147 174.729 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 CA-C-O 120.714 0.292 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 tttt 78.18 -70.69 0.11 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.784 1.634 . . . . 0.0 110.552 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 tttt 74.1 73.88 0.12 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.559 1.544 . . . . 0.0 110.519 170.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -43.4 98.06 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.616 1.567 . . . . 0.0 111.275 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -147.96 139.8 23.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.59 1.556 . . . . 0.0 110.035 172.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.8 m -108.13 102.99 12.1 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.65 1.58 . . . . 0.0 110.389 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.588 HD13 HH12 ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.53 23.74 2.51 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.407 1.883 . . . . 0.0 110.924 174.221 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.2 p -56.39 145.31 27.7 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.343 1.857 . . . . 0.0 110.799 175.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.462 ' HB3' HH12 ' A' ' 49' ' ' ARG . 17.4 m-20 -57.73 -24.48 57.14 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.514 1.526 . . . . 0.0 111.325 177.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.588 HH12 HD13 ' A' ' 7' ' ' LEU . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.691 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.675 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 2.9 tt0 -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.691 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.849 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.534 ' CD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.612 HG21 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.615 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.653 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.615 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.845 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.849 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.623 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.612 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.469 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.59 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.495 ' C ' HG11 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.755 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.641 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.653 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.456 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.623 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -47.73 129.3 11.17 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -33.53 82.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.09 1 C-N-CA 126.272 4.648 . . . . 0.0 115.818 -162.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.3 t70 58.57 56.76 4.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.079 1.752 . . . . 0.0 111.129 160.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.49 4.5 20.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.476 1.11 . . . . 0.0 110.666 175.359 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.463 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -78.46 169.55 18.08 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.64 1.576 . . . . 0.0 111.444 -166.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -102.12 80.43 0.3 Allowed Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.831 1.652 . . . . 0.0 111.023 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 76.1 Cg_exo -55.3 96.55 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.317 3.345 . . . . 0.0 112.581 -165.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.76 -72.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.713 2.405 . . . . 0.0 112.371 168.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.51 -176.72 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.982 1.713 . . . . 0.0 110.981 177.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -24.54 15.33 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.634 1.574 . . . . 0.0 111.371 176.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtm180 65.03 87.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.599 1.559 . . . . 0.0 111.114 -178.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.441 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER 179.52 127.0 0.07 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.513 1.925 . . . . 0.0 111.921 -176.107 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.441 ' H ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -119.55 -84.77 0.66 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.614 1.566 . . . . 0.0 111.189 -167.292 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -40.17 115.52 0.55 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.836 1.654 . . . . 0.0 110.627 177.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.472 ' O ' HG22 ' A' ' 87' ' ' ILE . 64.1 mt 56.78 89.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.567 1.547 . . . . 0.0 108.978 165.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.1 p -62.45 172.68 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.587 1.555 . . . . 0.0 110.062 171.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.96 39.74 3.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.578 1.551 . . . . 0.0 111.442 -170.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -92.26 121.3 33.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.555 1.542 . . . . 0.0 110.705 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -127.16 -71.48 0.67 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.571 1.548 . . . . 0.0 110.161 -178.542 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.2 mtt . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.376 0.131 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 tptt 52.54 96.2 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.614 1.566 . . . . 0.0 110.501 -171.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 14.9 mttm 39.49 -108.41 0.08 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.959 1.703 . . . . 0.0 110.4 -165.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 158.13 -152.76 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.594 1.558 . . . . 0.0 111.351 -164.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 m 89.03 34.65 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.019 1.728 . . . . 0.0 110.122 164.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 65.5 76.39 0.33 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.573 1.549 . . . . 0.0 110.584 164.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.67 19.5 4.62 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.369 1.868 . . . . 0.0 110.973 -175.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.472 HG22 ' OD1' ' A' ' 9' ' ' ASP . 2.5 m -59.15 170.93 0.81 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.333 1.853 . . . . 0.0 110.875 -175.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 -60.22 -27.31 67.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.185 1.394 . . . . 0.0 111.292 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.721 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.771 HG22 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.405 ' C ' ' HG2' ' A' ' 19' ' ' ARG . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.405 ' HG2' ' C ' ' A' ' 18' ' ' ALA . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' N ' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.551 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.742 HG21 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 HG12 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.977 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.771 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.742 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.551 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.511 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.061 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG13 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.886 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.556 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 1.061 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.426 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.542 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -78.78 -59.16 0.68 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.431 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 85.0 Cg_endo -86.76 -22.17 1.99 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.125 3.883 . . . . 0.0 113.003 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.0 t0 66.86 59.15 0.57 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.543 1.537 . . . . 0.0 110.966 -162.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.426 ' HB3' ' HG3' ' A' ' 70' ' ' LYS . 0.5 OUTLIER -83.38 150.59 25.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.977 1.311 . . . . 0.0 110.263 -162.317 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -88.89 158.1 18.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.746 1.618 . . . . 0.0 111.251 -175.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.434 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 18.2 p30 -57.77 168.68 1.03 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.595 1.558 . . . . 0.0 110.978 -177.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 84.9 Cg_exo -47.07 108.24 0.15 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.314 3.342 . . . . 0.0 112.563 176.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 2.9 ttm-85 23.56 -109.65 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.278 2.231 . . . . 0.0 111.772 -168.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.42 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 1.6 tt0 31.05 73.83 0.05 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.105 2.162 . . . . 0.0 111.616 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -60.65 -28.21 68.39 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.366 1.466 . . . . 0.0 111.374 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.67 99.14 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.551 1.54 . . . . 0.0 111.09 -164.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.409 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.2 OUTLIER 179.49 116.27 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.475 1.91 . . . . 0.0 111.943 -171.052 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.409 ' N ' HD22 ' A' ' 84' ' ' LEU . 1.8 p-10 -63.07 -156.75 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.228 1.811 . . . . 0.0 111.251 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 mttt 163.44 88.31 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.728 1.611 . . . . 0.0 110.512 -171.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.2 mt -100.96 149.56 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.617 1.567 . . . . 0.0 108.95 -171.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 p -78.32 -167.32 1.02 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.624 1.569 . . . . 0.0 110.024 175.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -100.01 -30.36 12.03 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.611 1.565 . . . . 0.0 111.405 -170.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.92 143.51 50.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.572 1.549 . . . . 0.0 110.742 -173.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.33 158.7 17.25 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.594 1.558 . . . . 0.0 110.345 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.546 1.538 . . . . 0.0 110.144 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 110.713 -0.106 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.6 mttp -134.06 -164.34 1.49 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.591 1.557 . . . . 0.0 110.508 -172.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt 69.3 115.67 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.59 1.556 . . . . 0.0 110.555 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 67.44 112.37 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.591 1.556 . . . . 0.0 111.281 -170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.3 95.53 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.592 1.557 . . . . 0.0 110.051 -167.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 m -122.18 131.96 54.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 110.342 -170.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.463 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -89.66 22.65 2.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.916 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.5 p -51.75 146.95 7.25 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.295 1.838 . . . . 0.0 110.81 174.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER -57.17 -23.68 49.18 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.497 1.519 . . . . 0.0 111.418 -170.163 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.97 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.867 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.97 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.714 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.867 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.56 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.689 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.979 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.412 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.912 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.941 HG22 HG23 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.644 HG23 ' HB ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.644 ' HB ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.921 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.586 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.86 ' HA ' HG22 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.787 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.787 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.941 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.921 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.699 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.664 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -81.22 172.06 10.68 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -55.12 82.12 0.03 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 124.357 3.372 . . . . 0.0 112.951 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -162.34 -70.57 0.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.943 1.697 . . . . 0.0 111.092 -168.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -100.96 85.69 2.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.802 1.241 . . . . 0.0 110.236 163.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.734 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -51.68 175.92 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.947 1.699 . . . . 0.0 111.429 166.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -89.14 79.19 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.997 1.719 . . . . 0.0 111.073 171.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 69.0 Cg_endo -79.87 7.06 4.82 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.473 3.449 . . . . 0.0 113.068 -168.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 ttp180 -24.02 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.863 2.465 . . . . 0.0 112.814 -161.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -25.56 -87.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 127.022 2.129 . . . . 0.0 111.658 167.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -148.6 -57.11 0.22 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.235 1.814 . . . . 0.0 110.95 160.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.26 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.565 1.946 . . . . 0.0 111.075 -172.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 mt 179.69 92.08 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.472 1.909 . . . . 0.0 112.142 -166.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -125.4 -68.71 0.82 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.886 2.075 . . . . 0.0 111.117 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -30.58 124.47 0.19 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.532 1.933 . . . . 0.0 110.873 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.75 155.14 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.806 1.642 . . . . 0.0 108.989 165.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.3 m -46.9 -51.49 16.66 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.585 1.554 . . . . 0.0 110.077 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 20.6 t60 -96.62 -71.42 0.68 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.571 1.548 . . . . 0.0 111.408 172.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 89' ' ' HIS . . . 166.34 -41.92 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.581 1.552 . . . . 0.0 110.706 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -123.19 -174.91 3.06 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.607 1.563 . . . . 0.0 110.385 -174.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.639 1.575 . . . . 0.0 110.193 -177.789 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -71.84 -27.52 62.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.571 1.548 . . . . 0.0 110.52 177.657 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -110.1 -178.32 3.49 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.603 1.561 . . . . 0.0 110.522 170.844 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 71.27 97.16 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.57 1.548 . . . . 0.0 111.29 -172.699 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.863 HG23 HD23 ' A' ' 7' ' ' LEU . 1.0 OUTLIER 63.53 112.92 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.61 1.564 . . . . 0.0 110.05 -175.503 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 m -99.61 74.74 1.89 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.556 1.543 . . . . 0.0 110.393 175.212 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.863 HD23 HG23 ' A' ' 5' ' ' THR . 0.2 OUTLIER -89.73 19.79 4.49 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.394 1.878 . . . . 0.0 110.92 -172.49 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p -48.52 152.43 0.93 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.291 1.836 . . . . 0.0 110.874 -175.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -60.55 -23.63 64.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.689 1.596 . . . . 0.0 111.377 173.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.981 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.446 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.664 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.93 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CD1' HG21 ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.702 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.7 ' CG2' ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.602 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.707 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.707 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.931 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.547 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.981 ' HA ' HG22 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.446 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.821 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.821 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.7 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.641 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.93 ' HB2' HG22 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HA ' HG13 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.931 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.455 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.833 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.702 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.644 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.644 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' HD3' ' CB ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -79.43 136.65 56.1 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -32.51 87.56 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.095 1 C-N-CA 126.41 4.74 . . . . 0.0 114.477 -164.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -153.9 -69.13 0.14 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.22 1.808 . . . . 0.0 111.115 -175.241 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.29 24.19 12.84 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.294 1.437 . . . . 0.0 110.462 164.269 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.41 124.01 34.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.502 1.521 . . . . 0.0 111.337 165.066 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 62.85 72.7 0.57 Allowed Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.511 1.524 . . . . 0.0 110.995 172.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.42 -31.68 48.99 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.309 3.339 . . . . 0.0 112.613 -177.377 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.1 OUTLIER -15.85 -100.76 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 128.4 2.68 . . . . 0.0 113.031 -163.448 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 0.1 OUTLIER 31.62 76.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.964 2.106 . . . . 0.0 111.553 -175.572 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 63.06 151.92 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.312 1.445 . . . . 0.0 111.402 -174.686 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -112.11 58.07 0.64 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.828 1.251 . . . . 0.0 110.43 160.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -38.62 133.4 1.05 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.132 2.173 . . . . 0.0 111.488 -178.26 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.582 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -101.56 150.99 22.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.321 1.448 . . . . 0.0 111.236 174.864 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 tptt 63.27 117.82 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.818 1.647 . . . . 0.0 110.538 -170.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 87' ' ' ILE . 3.9 tp 178.14 98.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 125.627 1.571 . . . . 0.0 108.927 169.048 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -84.48 -38.26 20.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.59 1.556 . . . . 0.0 110.049 -173.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.28 149.04 30.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.613 1.565 . . . . 0.0 111.419 -170.396 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -113.12 -75.83 0.6 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 110.732 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.32 -35.71 12.28 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.619 1.568 . . . . 0.0 110.357 -171.286 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.59 1.556 . . . . 0.0 110.145 -179.076 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 110.671 -0.122 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -160.47 130.35 5.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.575 1.55 . . . . 0.0 110.51 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 tttt 72.32 42.67 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.615 1.566 . . . . 0.0 110.543 -177.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 173.63 134.62 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.604 1.562 . . . . 0.0 111.234 -171.462 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.5 p -67.01 171.98 4.95 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.559 1.543 . . . . 0.0 110.106 179.797 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -103.55 118.59 37.09 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.611 1.565 . . . . 0.0 110.362 -172.864 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -89.71 22.86 2.89 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.375 1.87 . . . . 0.0 110.841 178.112 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 p -48.96 172.24 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.388 1.875 . . . . 0.0 110.882 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.527 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER -76.0 -32.75 59.57 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.275 1.43 . . . . 0.0 111.073 -178.591 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.024 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.811 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.024 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.772 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 1.028 HG22 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.924 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.557 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.499 HG23 ' H ' ' A' ' 36' ' ' ILE . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.499 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.808 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.924 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 1.028 ' HB3' HG22 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.433 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.723 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.473 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.527 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.596 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.808 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.902 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.441 ' HG2' ' HB2' ' A' ' 76' ' ' LYS . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.723 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.493 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 -63.2 120.86 65.47 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -39.77 91.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 125.162 3.908 . . . . 0.0 113.828 -167.398 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 49.7 t0 -145.7 -71.88 0.25 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.028 1.731 . . . . 0.0 111.115 -168.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 79' ' ' PRO . 0.8 OUTLIER -131.59 60.04 1.68 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.797 1.239 . . . . 0.0 110.303 163.853 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.44 74.46 7.75 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.803 1.641 . . . . 0.0 111.343 165.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 38.7 58.51 5.53 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.636 1.574 . . . . 0.0 111.058 -167.764 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.526 ' HG3' ' HA ' ' A' ' 76' ' ' LYS . 72.1 Cg_endo -70.66 -36.4 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.364 3.376 . . . . 0.0 112.663 175.865 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -21.46 -78.26 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.299 2.64 . . . . 0.0 112.847 -168.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 5.22 82.86 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.522 2.729 . . . . 0.0 112.58 -168.969 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.7 146.91 5.84 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.399 1.48 . . . . 0.0 111.543 177.091 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -96.19 78.54 3.12 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.772 1.629 . . . . 0.0 111.104 168.081 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER 179.51 160.9 0.8 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.512 1.925 . . . . 0.0 111.918 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.725 ' H ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -111.67 -71.6 0.75 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.592 1.557 . . . . 0.0 111.215 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -39.09 137.03 0.75 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.588 1.555 . . . . 0.0 110.489 172.454 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.2 tt -170.35 95.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.593 1.557 . . . . 0.0 108.938 173.934 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.9 m -75.21 89.99 2.55 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.595 1.558 . . . . 0.0 110.056 171.562 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -78.16 -34.03 49.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.648 1.579 . . . . 0.0 111.428 -177.808 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -155.29 -69.48 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.578 1.551 . . . . 0.0 110.7 -179.621 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.1 p -167.13 -46.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.597 1.559 . . . . 0.0 110.362 -178.438 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.649 1.58 . . . . 0.0 110.135 -176.237 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 mmt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -125.81 50.59 1.83 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.618 1.567 . . . . 0.0 110.538 172.684 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt 49.63 40.41 19.62 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.609 1.564 . . . . 0.0 110.52 -176.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.47 -151.87 0.23 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.538 1.535 . . . . 0.0 111.247 167.636 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.3 141.69 0.91 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.601 1.56 . . . . 0.0 110.011 177.43 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.832 ' HB2' HG23 ' A' ' 8' ' ' THR . 7.8 p -43.53 122.78 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.592 1.557 . . . . 0.0 110.436 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.72 23.28 2.73 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.377 1.871 . . . . 0.0 110.899 176.931 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.832 HG23 ' HB2' ' A' ' 6' ' ' CYS . 20.9 p -53.11 141.62 22.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.404 1.882 . . . . 0.0 110.827 174.544 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.7 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 -61.36 -28.35 69.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.754 1.621 . . . . 0.0 111.447 176.039 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.055 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.809 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.055 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.805 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.73 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.699 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.794 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.995 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.727 HG22 HG23 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.469 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.739 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 1.025 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 1.025 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.672 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.809 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.739 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.606 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.574 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.583 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.754 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.456 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.402 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.686 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.68 133.89 86.44 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -40.27 91.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 125.085 3.856 . . . . 0.0 113.957 -163.515 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.402 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.5 t0 -149.19 -67.1 0.22 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.172 1.789 . . . . 0.0 111.176 -177.841 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -145.0 96.21 2.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.168 1.387 . . . . 0.0 110.505 169.353 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.68 174.48 1.01 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.566 1.546 . . . . 0.0 111.329 -175.481 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -35.94 149.44 0.13 Allowed Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.987 1.715 . . . . 0.0 111.133 171.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' NH1' ' A' ' 43' ' ' ARG . 87.3 Cg_exo -50.98 134.36 42.34 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.314 3.342 . . . . 0.0 112.606 177.489 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.33 -76.1 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.864 2.466 . . . . 0.0 112.486 169.685 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -16.09 84.26 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 128.63 2.772 . . . . 0.0 112.819 -168.122 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.23 -37.88 7.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.809 1.643 . . . . 0.0 111.225 163.497 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 26.96 59.42 0.08 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.25 1.82 . . . . 0.0 111.074 -160.983 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.847 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER -37.02 127.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.954 2.102 . . . . 0.0 111.492 -178.517 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.847 ' N ' HD22 ' A' ' 84' ' ' LEU . 2.7 t0 -114.11 -83.22 0.61 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.224 1.41 . . . . 0.0 111.237 179.459 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 160.94 86.07 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.037 1.735 . . . . 0.0 110.36 -168.631 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 56.91 53.73 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.512 1.525 . . . . 0.0 108.963 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -61.34 -61.09 2.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.571 1.549 . . . . 0.0 110.096 174.133 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -115.69 153.5 31.23 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.609 1.563 . . . . 0.0 111.429 172.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.98 104.46 1.13 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.594 1.558 . . . . 0.0 110.698 175.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -102.77 -45.41 5.01 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.589 1.556 . . . . 0.0 110.317 -171.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 125.595 1.558 . . . . 0.0 110.135 -177.132 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtm . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.718 -0.104 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 169.99 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.636 1.574 . . . . 0.0 110.525 -177.348 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 88.62 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.62 1.568 . . . . 0.0 110.468 -174.475 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 52.21 -153.94 0.2 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.558 1.543 . . . . 0.0 111.288 179.503 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 50.83 -171.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.021 2.128 . . . . 0.0 110.221 177.52 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.3 m -140.62 102.74 4.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.602 1.561 . . . . 0.0 110.456 -171.202 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' OE1' ' A' ' 11' ' ' GLN . 1.2 mm? -89.68 22.82 2.89 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.348 1.859 . . . . 0.0 110.932 171.713 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -52.26 178.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.195 1.798 . . . . 0.0 110.814 173.664 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -26.09 42.9 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.398 1.079 . . . . 0.0 110.682 -172.812 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.026 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.841 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 1.026 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.841 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.517 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.004 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.8 HG22 HG23 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.595 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.592 HG23 ' N ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.592 ' N ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.772 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.678 ' HD2' ' HG3' ' A' ' 39' ' ' ARG . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.881 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.881 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.567 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.8 HG23 HG22 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.004 ' HB2' HG22 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.794 ' HA ' HG13 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.664 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.747 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -69.82 123.2 88.16 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.421 ' HD2' ' NE2' ' A' ' 73' ' ' GLN . 41.0 Cg_exo -38.17 90.04 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 125.201 3.934 . . . . 0.0 114.174 -163.661 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.451 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -136.28 -64.87 0.59 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.316 1.846 . . . . 0.0 111.052 -178.657 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.97 92.71 4.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 110.184 162.612 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.725 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -81.97 -179.69 7.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.227 1.811 . . . . 0.0 111.461 165.233 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.678 ' OD1' ' HD3' ' A' ' 79' ' ' PRO . 0.0 OUTLIER -23.7 -47.39 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 127.322 2.249 . . . . 0.0 112.184 171.007 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.725 ' HD2' ' C ' ' A' ' 77' ' ' ALA . 86.7 Cg_exo -42.76 90.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 125.199 3.933 . . . . 0.0 112.74 176.504 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.47 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 128.528 2.731 . . . . 0.0 113.366 -161.692 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.752 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 156.8 169.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.644 2.377 . . . . 0.0 111.823 -174.724 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.752 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 0.3 OUTLIER -148.15 113.35 5.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.506 1.523 . . . . 0.0 111.278 162.43 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 112.43 1.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.575 1.55 . . . . 0.0 111.139 166.7 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.435 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.9 tt 179.52 139.03 0.11 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.489 1.915 . . . . 0.0 111.934 -173.767 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -72.74 -70.99 0.32 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.674 1.59 . . . . 0.0 111.214 -165.637 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -40.51 100.66 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.127 1.771 . . . . 0.0 110.696 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -96.26 146.97 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.712 1.605 . . . . 0.0 108.972 -170.216 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.1 p -72.8 -34.14 66.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.59 1.556 . . . . 0.0 110.07 -175.627 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -94.22 70.1 3.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.601 1.56 . . . . 0.0 111.414 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.36 -85.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.557 1.543 . . . . 0.0 110.716 -172.185 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.24 -25.98 29.02 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.585 1.554 . . . . 0.0 110.341 -172.9 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.549 0 C-N-CA 125.583 1.553 . . . . 0.0 110.181 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -125.55 -98.75 0.41 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.615 1.566 . . . . 0.0 110.517 -175.48 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -113.56 107.79 16.28 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.593 1.557 . . . . 0.0 110.506 -170.319 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.474 ' CB ' ' CD2' ' A' ' 7' ' ' LEU . . . -179.79 -78.46 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.883 1.673 . . . . 0.0 111.066 176.34 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 18.3 p 52.54 110.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.414 2.286 . . . . 0.0 110.512 -170.785 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' THR . 29.0 t 95.99 64.57 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 128.379 2.672 . . . . 0.0 109.931 -164.459 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.474 ' CD2' ' CB ' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -89.85 14.67 11.43 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.459 1.904 . . . . 0.0 110.885 -174.091 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 154.39 6.39 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.783 1.233 . . . . 0.0 110.509 -163.584 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 -72.5 -20.42 61.37 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.026 1.73 . . . . 0.0 111.397 -163.735 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.784 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TRP . . . . . 0.789 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.784 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.752 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 1.017 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HD1' HG22 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.895 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.843 HG22 HG23 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.418 HG22 HG12 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 HG13 ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.579 HG13 HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.745 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.752 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.892 ' HA ' HG22 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.771 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.771 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.843 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 1.017 ' HB2' HG22 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.497 ' HA ' HG13 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.745 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.524 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.895 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.473 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.509 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.95 113.47 33.19 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -28.43 84.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.177 1 C-N-CA 126.375 4.717 . . . . 0.0 114.829 -163.101 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -130.63 -61.84 0.94 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.8 2.04 . . . . 0.0 110.878 -175.257 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.05 59.57 0.63 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.007 1.323 . . . . 0.0 109.911 160.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.641 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -90.04 99.61 12.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.88 1.672 . . . . 0.0 111.295 165.599 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -70.05 93.35 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.658 1.583 . . . . 0.0 110.997 -170.055 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.641 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 89.8 Cg_endo -71.94 -63.54 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.344 3.363 . . . . 0.0 112.688 -166.722 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.422 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 35.6 ttt180 16.06 -116.46 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.555 2.342 . . . . 0.0 111.924 -163.373 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.422 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 6.9 mm100 27.13 -91.34 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.195 2.198 . . . . 0.0 111.746 -173.633 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 170.75 154.08 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.224 1.81 . . . . 0.0 111.32 -177.951 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.9 ptt-85 -110.21 106.56 16.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.471 1.508 . . . . 0.0 111.117 166.132 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.501 ' HA ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER 179.58 113.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.509 1.923 . . . . 0.0 112.021 -172.497 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -41.22 -57.73 2.02 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.016 1.726 . . . . 0.0 111.325 -177.168 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.456 ' HD2' HD12 ' A' ' 87' ' ' ILE . 3.8 mmtt 50.99 -169.34 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.593 1.557 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.456 HD12 ' HD2' ' A' ' 86' ' ' LYS . 1.8 mp -94.13 151.28 3.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 125.65 1.58 . . . . 0.0 108.968 -177.599 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.35 135.84 35.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.631 1.573 . . . . 0.0 110.034 178.676 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -139.24 -45.68 0.46 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.584 1.554 . . . . 0.0 111.418 -174.866 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -46.72 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.772 -169.232 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.2 -164.9 0.23 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.527 1.531 . . . . 0.0 110.376 169.123 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 45.1 ttt85 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.615 1.566 . . . . 0.0 110.151 178.554 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 . . . . . 0 CA--C 1.544 0.744 0 N-CA-C 111.399 0.148 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.89 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.707 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.89 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.447 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.936 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.498 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.625 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.063 HG22 HG23 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.8 HG22 HG12 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.911 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.911 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.849 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.936 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 1.063 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.986 ' HB2' HG22 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.479 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.849 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.479 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.674 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.778 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.625 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.461 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.667 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.534 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 111.413 0.153 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.929 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.794 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.929 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.794 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 17' ' ' LEU . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.835 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.835 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.906 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.831 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.637 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.894 HG12 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.894 HG22 HG12 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.912 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.676 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.754 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.863 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.863 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.619 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.831 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.572 ' HE2' HG21 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.915 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.912 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.915 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.637 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.456 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.738 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.443 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.911 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.838 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.911 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.838 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.45 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CE1' ' HG2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.99 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.618 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.073 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.841 HG22 HG23 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.661 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.661 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.868 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.868 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.591 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.502 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HB3' ' CG1' ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.841 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.569 ' HE2' HG21 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.548 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.777 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.401 ' HA ' ' CE1' ' A' ' 37' ' ' PHE . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.591 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.769 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 10.8 m-20 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.888 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.522 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.747 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.888 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.92 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.735 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.735 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.05 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.646 ' CG2' HG23 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.744 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.744 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.848 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.724 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.92 ' HA ' HG22 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.447 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.646 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.05 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.848 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.519 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.873 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 1.01 ' HG2' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 1.01 ' CD ' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.535 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 111.382 0.141 . . . . 0.0 111.382 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.837 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.53 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.675 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.837 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.009 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.102 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.738 HG22 HG23 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.737 HG22 HG12 ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.886 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.886 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.846 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.626 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.738 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.102 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.524 ' HA ' HG13 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.458 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.451 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.787 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.505 ' NE2' ' HB2' ' A' ' 58' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.326 0.121 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.029 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.791 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.029 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.791 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.901 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.076 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HD1' HG22 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.847 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.894 HG22 HG23 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.736 HG22 HG12 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.667 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.667 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.865 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.634 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.901 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.783 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.441 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.894 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.076 ' HB2' HG22 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.865 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.535 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.681 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.812 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.498 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.498 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.388 0.144 . . . . 0.0 111.388 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.084 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.708 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.084 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.534 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' A' ' 29' ' ' PHE . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.626 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.465 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.962 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.948 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.726 ' HE2' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.798 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.457 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.911 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.962 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.613 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.757 ' HA ' HG13 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.911 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.719 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.665 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.47 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.798 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.956 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.697 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.956 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.873 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.402 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.842 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.797 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.039 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.68 ' HD1' HG22 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.846 HG22 HG23 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.624 HG22 HG12 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.674 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.685 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.705 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.896 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.873 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.801 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.801 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.578 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.846 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.472 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HB2' HG22 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.639 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.896 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.639 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.686 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.63 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.685 ' HD1' ' C ' ' A' ' 35' ' ' GLY . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.44 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.705 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.614 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 111.333 0.123 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.937 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' A' ' 9' ' ' ASP . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.937 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.459 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.489 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.015 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.993 HG12 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.993 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.602 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.824 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.738 ' HA ' HG22 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.758 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.758 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.47 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.81 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.015 ' HB2' HG22 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.824 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.637 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.504 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.465 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.788 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.501 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.65 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.788 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.65 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.485 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.861 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.996 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.507 ' HD1' HG22 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.053 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.66 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' HB ' HG23 ' A' ' 34' ' ' THR . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.864 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.671 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.861 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.517 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.488 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.635 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.501 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.053 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.53 ' HA ' HG13 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.864 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.466 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.441 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.441 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.613 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.54 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.735 0 N-CA-C 111.401 0.149 . . . . 0.0 111.401 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.667 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.896 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.782 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.906 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.474 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.79 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.073 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.767 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.949 HG12 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.949 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.579 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.786 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.886 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.906 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . 0.469 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.54 ' NH2' ' HB2' ' A' ' 9' ' ' ASP . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.92 HG23 HG22 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.489 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.585 ' HA ' HG13 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.675 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.786 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.412 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.426 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.561 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.437 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.496 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.969 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.523 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.969 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.477 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.771 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.987 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.605 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.623 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.838 HG22 HG23 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.57 HG22 HG12 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.891 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.891 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.895 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.992 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.992 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.954 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.838 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.987 ' HB2' HG22 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG13 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.895 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.505 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG3' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.702 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.505 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.559 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.623 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.433 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.954 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.955 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.85 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.955 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.732 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.845 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.002 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.592 ' HD1' HG22 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.958 HG22 HG23 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.635 HG22 HG12 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.577 HG23 ' N ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.577 ' N ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.905 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.845 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.846 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.846 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.732 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.905 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.732 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.555 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.432 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.41 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.432 ' CG ' ' HB3' ' A' ' 68' ' ' PRO . 7.5 tp60 . . . . . 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.668 0.27 . . . . 0.0 111.339 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.848 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.774 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.848 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.579 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.604 ' HD2' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.704 HG22 HG23 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.493 HG23 HG13 ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.493 HG13 HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.838 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.895 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.422 ' HB2' ' ND2' ' A' ' 51' ' ' ASN . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.422 ' ND2' ' HB2' ' A' ' 48' ' ' LEU . 66.7 m-20 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.037 ' HB2' HG22 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.838 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.497 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.625 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 . . . . . 0 CA--C 1.544 0.737 0 N-CA-C 111.328 0.122 . . . . 0.0 111.328 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.433 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.711 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.838 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.758 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.651 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.869 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.821 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.042 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.714 ' CG2' HG23 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.491 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.889 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.869 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.821 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.426 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.664 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.445 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.714 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.042 ' HB2' HG22 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.567 ' HA ' HG13 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.889 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.469 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.575 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.664 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.425 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 111.317 0.117 . . . . 0.0 111.317 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.946 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.823 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.946 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.823 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.617 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.658 ' CG1' HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.658 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.859 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.859 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.83 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.856 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.559 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.635 ' H ' ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 48' ' ' LEU . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.5 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.807 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.486 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.83 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.639 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.622 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.408 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.862 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.478 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.489 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.504 0.192 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.686 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.686 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.656 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' O ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.73 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.816 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.997 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.964 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.964 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.752 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.737 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.725 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.997 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.725 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.73 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.474 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.752 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.461 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.779 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.462 ' HB3' HH12 ' A' ' 49' ' ' ARG . 17.4 m-20 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.451 0.167 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.675 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.691 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.675 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.691 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.849 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.534 ' CD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.612 HG21 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.615 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.653 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.615 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.845 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.849 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.623 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.612 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.469 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.59 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.495 ' C ' HG11 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.755 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.641 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.653 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.456 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.623 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 120.454 0.168 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.721 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.771 HG22 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.405 ' C ' ' HG2' ' A' ' 19' ' ' ARG . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.405 ' HG2' ' C ' ' A' ' 18' ' ' ALA . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.434 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.574 ' N ' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.551 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.742 HG21 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 HG12 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.572 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.977 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.771 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.742 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.551 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.511 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.061 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG13 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.886 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.556 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 1.061 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.542 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER . . . . . 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.97 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.867 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.97 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.714 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.867 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.56 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.689 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.979 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.412 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.912 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.941 HG22 HG23 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.644 HG23 ' HB ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.644 ' HB ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.921 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.586 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.86 ' HA ' HG22 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.787 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.787 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.941 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.921 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.699 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.664 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 CA-C-O 120.82 0.343 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.981 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.446 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.664 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.93 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CD1' HG21 ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.702 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.7 ' CG2' ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.602 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.707 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.707 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.931 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.547 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.981 ' HA ' HG22 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.446 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.821 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.821 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.7 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.641 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.93 ' HB2' HG22 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HA ' HG13 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.931 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.455 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.833 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.702 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.644 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.644 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.434 ' HD3' ' CB ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.527 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 CA-C-O 120.455 0.169 . . . . 0.0 111.073 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.024 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.811 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.024 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.772 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 1.028 HG22 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.924 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.557 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.499 HG23 ' H ' ' A' ' 36' ' ' ILE . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.499 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.808 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.924 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 1.028 ' HB3' HG22 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.433 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.723 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.473 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.527 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.596 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.808 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.902 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.723 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.493 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.7 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 111.447 0.166 . . . . 0.0 111.447 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.055 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.809 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.055 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.805 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.73 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.699 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.794 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.995 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.727 HG22 HG23 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.469 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.739 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 1.025 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 1.025 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.672 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.406 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.809 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.739 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.606 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.574 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.583 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.754 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.456 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.686 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.549 0.91 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.026 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.841 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 1.026 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.841 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.517 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.004 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.8 HG22 HG23 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.595 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.592 HG23 ' N ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.592 ' N ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.772 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.678 ' HD2' ' HG3' ' A' ' 39' ' ' ARG . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.881 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.881 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.567 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.8 HG23 HG22 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.004 ' HB2' HG22 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.794 ' HA ' HG13 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.664 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.747 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 120.805 0.336 . . . . 0.0 111.397 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.784 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . 0.789 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.784 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.752 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 1.017 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HD1' HG22 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.895 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.843 HG22 HG23 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.418 HG22 HG12 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 HG13 ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.579 HG13 HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.745 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.752 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.892 ' HA ' HG22 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.771 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.771 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.843 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 1.017 ' HB2' HG22 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.497 ' HA ' HG13 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.745 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.524 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.895 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.473 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.509 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER . . . . . 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtp . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 110.73 -0.1 . . . . 0.0 110.73 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 mttt -92.17 76.03 5.37 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.56 170.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm 168.24 151.74 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.561 1.545 . . . . 0.0 110.506 -171.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.48 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . 172.87 47.65 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.58 1.552 . . . . 0.0 111.27 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 47.17 -96.13 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.83 1.652 . . . . 0.0 110.106 167.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -133.38 104.46 6.44 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.541 1.536 . . . . 0.0 110.385 -175.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.48 HD21 ' HB1' ' A' ' 4' ' ' ALA . 2.0 mm? -89.69 22.25 3.14 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 126.385 1.874 . . . . 0.0 110.938 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.3 p -53.56 148.12 9.96 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.287 1.835 . . . . 0.0 110.839 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -54.29 -21.67 9.88 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.58 1.552 . . . . 0.0 111.399 174.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -41.67 -75.93 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.364 1.465 . . . . 0.0 111.1 163.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.89 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.25 -21.56 56.2 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.249 1.02 . . . . 0.0 110.883 -168.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.473 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.05 -58.15 2.2 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 123.233 1.492 . . . . 0.0 110.008 160.333 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.707 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 24.6 t-105 -72.52 -19.3 61.55 Favored 'General case' 0 C--N 1.363 1.186 0 CA-C-N 114.395 -1.275 . . . . 0.0 112.029 176.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.89 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 1.2 tt0 -67.33 -53.8 26.29 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.066 0.848 . . . . 0.0 110.458 172.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.3 m -57.6 -32.13 66.89 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.929 1.291 . . . . 0.0 112.551 172.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.8 t -89.25 -26.57 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.074 1.75 . . . . 0.0 110.692 -175.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.468 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 7.0 mt -75.98 -40.68 53.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.168 1.387 . . . . 0.0 110.668 171.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.77 -21.93 44.22 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.844 1.658 . . . . 0.0 110.558 175.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 76.55 30.23 0.64 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.004 1.722 . . . . 0.0 111.087 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -51.21 89.17 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.903 1.681 . . . . 0.0 110.607 -168.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.447 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 39.2 Cg_exo -62.68 -18.23 62.93 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.224 3.282 . . . . 0.0 112.933 -163.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -110.82 21.4 16.54 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.245 1.818 . . . . 0.0 110.922 -166.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.936 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -95.76 14.38 23.4 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.44 1.496 . . . . 0.0 111.476 -176.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.96 126.5 27.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.231 1.412 . . . . 0.0 111.045 162.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.14 -29.03 6.78 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.67 1.605 . . . . 0.0 112.169 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.0 -38.39 75.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.62 1.568 . . . . 0.0 110.533 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.498 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.2 p90 -177.98 -174.95 0.46 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.364 1.465 . . . . 0.0 111.422 170.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.986 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.7 m -130.15 170.07 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 125.906 1.682 . . . . 0.0 109.599 160.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.44 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.3 p90 -136.13 143.88 44.76 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.921 1.288 . . . . 0.0 110.95 169.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.625 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -128.15 108.71 10.86 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.091 1.757 . . . . 0.0 111.661 -161.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.063 HG22 HG23 ' A' ' 52' ' ' VAL . 78.9 t -89.51 92.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.306 1.442 . . . . 0.0 110.083 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.13 -23.23 5.1 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.485 1.514 . . . . 0.0 111.349 -169.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.8 HG22 HG12 ' A' ' 31' ' ' VAL . 11.5 t -77.88 -33.22 52.12 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 110.871 -167.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.911 HG23 HG13 ' A' ' 36' ' ' ILE . 3.2 t -100.15 -12.98 19.16 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.617 1.567 . . . . 0.0 111.138 171.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.26 29.23 73.87 Favored Glycine 0 CA--C 1.542 1.743 0 C-N-CA 125.446 1.498 . . . . 0.0 111.836 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.911 HG13 HG23 ' A' ' 34' ' ' THR . 14.1 mt -105.23 158.3 5.86 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 C-N-CA 125.628 1.571 . . . . 0.0 110.05 172.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.849 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.1 p90 -128.01 157.55 40.33 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.931 1.692 . . . . 0.0 111.213 170.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.7 m -144.75 171.48 14.35 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.84 2.056 . . . . 0.0 111.291 -162.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 34.8 ttp180 -93.26 152.5 41.22 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 127.062 2.145 . . . . 0.0 108.894 158.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.936 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.6 Cg_endo -42.38 -23.62 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 124.573 3.515 . . . . 0.0 115.506 -175.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 4.9 t -78.56 8.97 4.44 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 127.028 2.131 . . . . 0.0 113.288 -163.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.3 t -60.64 94.72 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 CA-C-N 119.492 1.042 . . . . 0.0 110.389 -161.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -70.98 -30.75 67.09 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.878 1.671 . . . . 0.0 111.525 -161.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.7 144.23 33.28 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.281 1.432 . . . . 0.0 111.176 171.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.7 mmt180 -45.48 106.78 0.08 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.562 1.545 . . . . 0.0 110.918 -170.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 41.9 m170 -45.75 144.8 1.57 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.946 1.698 . . . . 0.0 111.725 -163.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.44 130.13 40.92 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.508 1.523 . . . . 0.0 111.041 162.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -47.63 148.38 1.5 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.484 1.514 . . . . 0.0 111.041 -162.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -45.36 -30.92 1.44 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.247 1.819 . . . . 0.0 111.365 165.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -77.94 -18.32 56.2 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 125.743 1.617 . . . . 0.0 112.287 -167.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -106.32 5.02 29.27 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.122 1.769 . . . . 0.0 111.447 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 1.063 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -125.91 132.33 70.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.162 1.785 . . . . 0.0 109.946 -163.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -136.61 155.93 49.24 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.031 1.332 . . . . 0.0 111.878 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 57.8 m-85 -115.02 133.24 56.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.675 1.59 . . . . 0.0 112.347 -160.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.986 ' HB2' HG22 ' A' ' 28' ' ' VAL . 3.6 m-85 -112.56 179.32 4.01 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 129.214 3.006 . . . . 0.0 111.543 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.64 -43.82 53.52 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.683 1.593 . . . . 0.0 111.617 163.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.479 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 2.3 p30 -160.23 179.88 8.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.455 1.502 . . . . 0.0 111.505 -173.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.849 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.83 -18.9 53.28 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.248 1.819 . . . . 0.0 111.793 -171.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.479 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 19.4 m -70.25 -33.7 71.93 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.686 1.594 . . . . 0.0 111.945 171.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.674 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.7 tp10 -65.0 -45.83 83.93 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.707 1.603 . . . . 0.0 109.928 167.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.778 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -68.2 -28.56 67.37 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.186 1.394 . . . . 0.0 110.998 177.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.476 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.9 mt -68.98 -38.71 79.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.188 1.795 . . . . 0.0 110.405 166.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.674 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.79 -27.33 66.47 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.01 1.724 . . . . 0.0 111.536 171.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.29 -12.05 58.25 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.513 1.525 . . . . 0.0 111.561 174.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.86 36.97 17.45 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.717 1.627 . . . . 0.0 111.956 176.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.625 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 6.3 m-30 -103.69 174.97 5.64 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.776 1.63 . . . . 0.0 110.851 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.1 mtm-85 -118.98 149.64 47.13 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 125.813 1.645 . . . . 0.0 111.391 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.461 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 46.1 Cg_endo -63.14 125.39 15.7 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.43 3.42 . . . . 0.0 115.289 174.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.667 ' HA ' HG21 ' A' ' 36' ' ' ILE . 36.6 t -56.51 140.35 46.48 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.427 2.291 . . . . 0.0 110.859 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -68.83 -1.65 7.68 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.065 1.746 . . . . 0.0 111.71 -169.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -123.74 -37.92 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.527 2.331 . . . . 0.0 111.927 -172.04 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 22.6 m -95.13 -54.3 3.48 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.367 2.267 . . . . 0.0 111.5 -162.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.534 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -86.31 -57.02 0.35 Allowed Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.002 1.321 . . . . 0.0 111.259 -160.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.461 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 56.9 Cg_endo -79.28 -32.64 1.67 Allowed 'Trans proline' 0 CA--C 1.545 1.049 0 C-N-CA 124.677 3.584 . . . . 0.0 113.319 165.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 t70 75.87 62.3 0.05 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.002 1.721 . . . . 0.0 111.073 -161.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -103.17 45.97 0.94 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.72 1.208 . . . . 0.0 110.242 -167.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.52 130.7 43.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.685 1.594 . . . . 0.0 111.273 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' N ' ' CD ' ' A' ' 79' ' ' PRO . 1.3 p-10 -126.67 34.95 0.27 Allowed Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.522 1.529 . . . . 0.0 111.241 -169.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 78' ' ' ASN . 86.5 Cg_endo -73.57 -88.54 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 124.251 3.301 . . . . 0.0 112.55 -166.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.426 ' NE ' ' HA ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -23.19 -70.77 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 127.663 2.385 . . . . 0.0 112.368 169.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 82' ' ' HIS . 2.4 tt0 -15.97 123.28 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 128.526 2.73 . . . . 0.0 112.685 177.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.433 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 0.2 OUTLIER -28.52 134.47 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.122 1.769 . . . . 0.0 111.682 164.037 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.441 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.8 OUTLIER -97.35 56.01 1.31 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.571 1.148 . . . . 0.0 110.113 160.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.547 HD22 ' H ' ' A' ' 85' ' ' ASP . 0.1 OUTLIER -42.43 154.29 0.06 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.371 2.269 . . . . 0.0 111.561 -174.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.547 ' H ' HD22 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -39.86 -81.76 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.603 1.961 . . . . 0.0 111.693 -164.853 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 167.04 -48.52 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.414 1.886 . . . . 0.0 110.347 164.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.2 mt -53.25 137.55 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 125.619 1.567 . . . . 0.0 108.98 -165.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.4 HG23 ' CD2' ' A' ' 89' ' ' HIS . 12.3 t -77.22 163.31 26.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.582 1.553 . . . . 0.0 110.068 -177.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.4 ' CD2' HG23 ' A' ' 88' ' ' THR . 14.9 m-70 59.44 93.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.591 1.556 . . . . 0.0 111.38 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -137.54 77.61 1.64 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.632 1.573 . . . . 0.0 110.731 177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -80.42 -42.78 22.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.552 1.541 . . . . 0.0 110.384 -175.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.587 1.555 . . . . 0.0 110.161 176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 CA--C 1.544 0.748 0 CA-C-O 120.382 0.134 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.67 12.04 8.66 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.663 1.585 . . . . 0.0 110.714 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt 41.27 67.21 0.56 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.501 1.52 . . . . 0.0 110.454 -167.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 170.94 -56.19 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.838 1.655 . . . . 0.0 111.102 -175.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.7 m 89.54 -84.45 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.039 1.735 . . . . 0.0 110.267 163.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.3 m -102.29 48.19 0.88 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.408 1.483 . . . . 0.0 110.665 -163.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.37 23.91 2.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.3 1.84 . . . . 0.0 111.065 168.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.3 157.68 30.6 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.702 2.001 . . . . 0.0 110.769 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -72.01 -33.85 68.4 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.421 1.488 . . . . 0.0 111.413 -170.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -40.84 -69.87 0.12 Allowed 'General case' 0 CA--C 1.543 0.712 0 C-N-CA 125.55 1.54 . . . . 0.0 111.28 164.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.929 ' NE2' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -73.82 -30.0 62.46 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.64 1.576 . . . . 0.0 110.342 -169.65 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -41.18 -60.57 1.2 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-O 123.171 1.462 . . . . 0.0 110.262 163.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.794 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 23.3 t-105 -70.19 -16.32 63.05 Favored 'General case' 0 C--N 1.363 1.189 0 CA-C-N 114.608 -1.178 . . . . 0.0 112.103 176.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.929 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 1.1 tm0? -72.9 -53.96 9.96 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 118.87 0.759 . . . . 0.0 110.443 173.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 12.6 m -53.9 -31.09 48.86 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.169 1.388 . . . . 0.0 113.158 169.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.794 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 6.1 t -88.4 -34.62 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.839 1.656 . . . . 0.0 110.763 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 17' ' ' LEU . 4.7 mt -69.84 -38.11 76.4 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.287 1.435 . . . . 0.0 110.869 173.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.83 -19.52 17.79 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.577 1.551 . . . . 0.0 110.378 170.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 63.92 25.44 13.95 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.143 1.377 . . . . 0.0 110.65 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -66.18 98.38 0.15 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 126.206 1.802 . . . . 0.0 110.891 -164.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.43 -13.05 30.63 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.119 3.213 . . . . 0.0 113.011 -167.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -101.08 23.25 11.06 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.434 1.894 . . . . 0.0 111.117 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.835 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -115.6 31.94 6.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.717 1.607 . . . . 0.0 110.902 168.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 29.0 t0 -40.93 -98.47 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.564 1.945 . . . . 0.0 111.412 165.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -37.1 -29.13 0.03 OUTLIER Glycine 0 CA--C 1.543 1.844 0 C-N-CA 126.934 2.207 . . . . 0.0 113.7 171.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.97 -38.17 90.1 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.678 1.591 . . . . 0.0 110.482 -169.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.835 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -175.85 -178.06 1.01 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.425 1.49 . . . . 0.0 111.578 176.433 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.906 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -127.24 175.15 9.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.852 2.061 . . . . 0.0 109.625 161.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.831 ' HD2' ' CG2' ' A' ' 52' ' ' VAL . 3.7 p90 -140.87 155.26 46.36 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.459 1.104 . . . . 0.0 111.432 163.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.637 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.14 108.23 8.69 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.122 1.769 . . . . 0.0 111.714 -161.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.894 HG12 HG22 ' A' ' 33' ' ' THR . 92.8 t -88.88 91.16 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.107 1.363 . . . . 0.0 110.055 177.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -51.6 -23.14 3.91 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.493 1.517 . . . . 0.0 111.248 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.894 HG22 HG12 ' A' ' 31' ' ' VAL . 1.7 t -69.84 -39.72 76.25 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.813 1.645 . . . . 0.0 110.825 -170.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.572 HG23 ' HB ' ' A' ' 36' ' ' ILE . 12.2 t -100.0 -1.26 37.53 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.619 1.568 . . . . 0.0 111.267 167.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 43.92 35.01 3.17 Favored Glycine 0 N--CA 1.496 2.666 0 N-CA-C 108.661 -1.776 . . . . 0.0 108.661 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' HB ' HG23 ' A' ' 34' ' ' THR . 26.3 mt -93.62 154.72 3.24 Favored 'Isoleucine or valine' 0 C--N 1.361 1.108 0 C-N-CA 125.981 1.712 . . . . 0.0 109.838 167.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.912 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 2.9 p90 -126.05 155.1 42.05 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.405 1.482 . . . . 0.0 111.113 168.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.539 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 93.6 m -138.24 171.29 14.62 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.685 2.394 . . . . 0.0 110.706 -166.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.676 ' O ' ' HE1' ' A' ' 29' ' ' PHE . 0.2 OUTLIER -88.29 158.27 49.41 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 126.852 2.061 . . . . 0.0 109.191 158.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.754 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 16.2 Cg_endo -49.32 -18.1 1.97 Allowed 'Trans proline' 0 CA--C 1.547 1.153 0 C-N-CA 124.348 3.366 . . . . 0.0 115.52 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.39 15.67 10.2 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 126.058 1.743 . . . . 0.0 112.09 -161.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.7 t -64.96 107.63 1.55 Allowed 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 119.614 1.097 . . . . 0.0 110.384 -161.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.863 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.07 -54.85 9.7 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.833 1.653 . . . . 0.0 111.384 -161.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.863 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -44.74 144.08 1.23 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.265 1.426 . . . . 0.0 111.005 174.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -43.16 105.79 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.661 1.584 . . . . 0.0 110.904 -173.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -42.51 144.82 0.48 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.913 1.685 . . . . 0.0 111.496 -164.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.619 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.13 127.74 33.87 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.364 1.466 . . . . 0.0 111.072 163.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.71 143.28 2.84 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.676 1.59 . . . . 0.0 110.808 -164.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.11 -32.1 0.66 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.917 1.687 . . . . 0.0 111.242 167.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.14 -21.98 53.3 Favored 'General case' 0 C--N 1.351 0.663 0 C-N-CA 126.071 1.749 . . . . 0.0 111.829 -165.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 -99.09 -14.61 19.32 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.989 2.115 . . . . 0.0 111.209 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.831 ' CG2' ' HD2' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -97.89 134.21 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 126.207 1.803 . . . . 0.0 110.179 -170.529 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 p -139.58 154.73 47.67 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.562 1.545 . . . . 0.0 111.766 169.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.572 ' HE2' HG21 ' A' ' 16' ' ' VAL . 15.8 m-85 -113.82 139.33 49.23 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.761 1.624 . . . . 0.0 112.533 -160.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.915 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 2.6 m-85 -116.44 178.15 4.43 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 129.237 3.015 . . . . 0.0 111.633 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.29 -42.46 65.5 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 125.393 1.477 . . . . 0.0 111.538 164.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.596 ' HA ' HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -160.14 -179.74 8.01 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.212 1.405 . . . . 0.0 111.615 -179.144 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.912 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.87 -12.66 59.38 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.422 1.889 . . . . 0.0 111.561 -170.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 53.0 m -71.35 -40.55 70.59 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.087 1.755 . . . . 0.0 111.749 168.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.618 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 mt-10 -61.22 -42.02 97.87 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.856 1.662 . . . . 0.0 109.797 167.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.915 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -72.86 -29.71 63.4 Favored 'General case' 0 C--N 1.356 0.879 0 C-N-CA 125.284 1.433 . . . . 0.0 111.022 178.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.472 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.1 mt -66.91 -38.47 86.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 126.187 1.795 . . . . 0.0 110.386 164.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -64.23 -17.99 64.1 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.984 1.714 . . . . 0.0 111.265 168.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -82.61 -12.18 57.87 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.348 1.459 . . . . 0.0 111.481 169.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 100.13 -11.33 60.32 Favored Glycine 0 CA--C 1.551 2.339 0 C-N-CA 124.117 0.865 . . . . 0.0 113.27 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.637 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 4.7 m-30 -79.71 168.55 19.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.161 1.784 . . . . 0.0 111.888 -160.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.456 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -115.2 149.97 43.58 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 126.936 2.094 . . . . 0.0 111.285 -177.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 63.4 Cg_endo -67.37 124.0 11.54 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.311 3.34 . . . . 0.0 115.236 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 37.0 t -50.24 148.07 3.79 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.591 1.956 . . . . 0.0 110.779 175.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.07 11.01 6.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.307 1.443 . . . . 0.0 110.691 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -135.19 -42.97 0.71 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.35 1.86 . . . . 0.0 111.0 -162.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -102.32 -72.92 0.67 Allowed 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.731 1.212 . . . . 0.0 111.192 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.738 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -49.91 -54.48 32.04 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.757 1.223 . . . . 0.0 110.439 -161.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.49 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 49.6 Cg_endo -92.4 -98.97 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 124.911 3.741 . . . . 0.0 113.123 169.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 177.3 49.58 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.476 1.911 . . . . 0.0 110.667 169.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' HG2' ' A' ' 74' ' ' PRO . 24.0 mmmt -90.78 37.65 0.93 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.182 1.393 . . . . 0.0 110.739 -161.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -56.14 152.08 11.27 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.468 1.507 . . . . 0.0 111.206 166.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -145.2 56.31 3.54 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.641 1.576 . . . . 0.0 111.013 -172.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -67.3 110.94 2.14 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.361 3.374 . . . . 0.0 112.532 -177.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -20.93 -71.21 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.829 2.452 . . . . 0.0 112.39 171.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.527 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 59.21 -177.07 0.09 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.77 1.628 . . . . 0.0 110.981 175.12 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.527 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 20.4 t60 -98.02 17.9 17.29 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.558 1.543 . . . . 0.0 111.393 -171.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 48.39 91.73 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.578 1.551 . . . . 0.0 111.157 -170.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 179.5 108.3 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 126.502 1.921 . . . . 0.0 111.954 -171.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -148.44 -145.3 0.17 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.571 1.548 . . . . 0.0 111.162 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.3 mttm 64.48 -172.67 0.18 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.598 1.559 . . . . 0.0 110.535 167.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.473 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.2 tp -124.49 52.93 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.13 1.772 . . . . 0.0 108.956 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.8 p -61.19 171.22 1.39 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.677 1.591 . . . . 0.0 110.037 173.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -63.34 134.04 55.11 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.613 1.565 . . . . 0.0 111.428 172.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 62.63 -174.21 0.15 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.545 1.538 . . . . 0.0 110.759 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.7 m -138.67 40.89 2.19 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.597 1.559 . . . . 0.0 110.36 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 . . . . . 0 N--CA 1.47 0.557 0 C-N-CA 125.621 1.568 . . . . 0.0 110.122 -169.454 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.701 -0.111 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -130.87 27.71 4.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 110.472 172.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.8 mttp -148.02 -169.01 3.23 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.575 1.55 . . . . 0.0 110.502 -169.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 177.65 -156.19 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.562 1.545 . . . . 0.0 111.241 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.7 p -50.18 160.87 0.32 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.587 1.555 . . . . 0.0 110.058 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 m -100.51 62.79 1.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.606 1.562 . . . . 0.0 110.387 -172.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -89.59 19.62 4.49 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.38 1.872 . . . . 0.0 110.927 172.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.5 m -58.56 164.85 2.43 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.244 1.818 . . . . 0.0 110.815 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.443 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 3.4 m-20 -66.1 -28.18 68.62 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.459 1.503 . . . . 0.0 111.337 -172.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -42.38 -72.95 0.05 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.455 1.502 . . . . 0.0 111.112 168.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.911 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -74.44 -23.85 58.98 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.213 1.005 . . . . 0.0 110.599 -170.363 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -40.09 -59.64 1.2 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.168 1.387 . . . . 0.0 110.516 160.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.838 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 28.3 t-105 -72.05 -17.94 61.98 Favored 'General case' 0 C--N 1.361 1.073 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.097 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.911 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.0 OUTLIER -65.1 -60.05 3.45 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 118.992 0.815 . . . . 0.0 110.357 170.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.3 t -65.66 -16.4 63.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.003 1.321 . . . . 0.0 113.064 178.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.838 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.0 t -87.88 -38.8 12.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 125.612 1.565 . . . . 0.0 111.145 171.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.6 mt -67.21 -38.23 84.96 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.975 1.31 . . . . 0.0 110.513 174.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.403 ' C ' ' CG ' ' A' ' 19' ' ' ARG . . . -64.54 -13.91 54.96 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.439 1.896 . . . . 0.0 111.079 172.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.403 ' CG ' ' C ' ' A' ' 18' ' ' ALA . 0.1 OUTLIER 52.38 34.02 14.17 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.791 1.637 . . . . 0.0 110.315 178.116 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -55.46 99.32 0.19 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 126.303 1.841 . . . . 0.0 110.807 -172.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.45 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 20.0 Cg_endo -58.79 -27.18 83.05 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 124.455 3.436 . . . . 0.0 112.92 -163.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -91.49 10.45 27.74 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.669 1.988 . . . . 0.0 111.162 -169.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HB1' ' HG2' ' A' ' 40' ' ' PRO . . . -84.45 3.56 35.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.551 1.541 . . . . 0.0 111.403 -177.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -54.62 114.02 1.53 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.241 1.417 . . . . 0.0 111.067 162.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.12 -35.94 4.68 Favored Glycine 0 CA--C 1.543 1.797 0 C-N-CA 125.635 1.588 . . . . 0.0 112.206 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 2.9 tp10 -70.82 -39.35 73.1 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.933 1.693 . . . . 0.0 110.64 -174.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' CE1' ' HG2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -172.68 -178.7 1.97 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.288 1.435 . . . . 0.0 111.649 170.779 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.99 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -123.8 173.25 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 126.299 1.839 . . . . 0.0 109.685 161.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.618 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 37.1 p90 -139.24 151.85 46.84 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.639 1.176 . . . . 0.0 111.284 166.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.073 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -132.05 108.14 9.12 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.054 1.742 . . . . 0.0 111.749 -161.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.841 HG22 HG23 ' A' ' 52' ' ' VAL . 93.9 t -89.34 106.61 17.15 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.202 1.401 . . . . 0.0 110.041 -177.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.97 64.0 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.591 1.556 . . . . 0.0 111.417 -166.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 t -102.32 -13.11 17.47 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.359 1.464 . . . . 0.0 110.965 -163.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.661 HG23 HG13 ' A' ' 36' ' ' ILE . 4.9 t -101.65 -22.75 14.37 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.583 1.553 . . . . 0.0 110.884 168.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 37.56 94.72 Favored Glycine 0 CA--C 1.543 1.796 0 C-N-CA 125.562 1.553 . . . . 0.0 111.879 -170.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.661 HG13 HG23 ' A' ' 34' ' ' THR . 28.2 mt -120.67 158.99 22.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.095 1.758 . . . . 0.0 109.902 176.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.769 ' HE1' ' HG3' ' A' ' 73' ' ' GLN . 0.2 OUTLIER -128.32 159.14 36.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.843 1.657 . . . . 0.0 111.026 166.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.9 m -143.67 174.59 10.66 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.938 2.095 . . . . 0.0 110.926 -164.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.868 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.3 ttm180 -98.52 154.54 37.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 127.039 2.136 . . . . 0.0 109.111 159.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.868 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 68.5 Cg_exo -51.1 -15.34 1.96 Allowed 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 123.989 3.126 . . . . 0.0 115.631 -171.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.45 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 11.6 t -85.19 12.53 7.77 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 126.951 2.1 . . . . 0.0 112.989 -167.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.7 t -63.45 90.98 0.05 Allowed 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 119.57 1.077 . . . . 0.0 110.511 -161.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.591 ' HD2' ' CZ ' ' A' ' 71' ' ' ARG . 0.7 OUTLIER -68.46 -33.02 73.44 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.501 1.521 . . . . 0.0 110.962 -166.37 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.49 123.89 20.41 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.549 1.54 . . . . 0.0 111.164 165.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HD2' ' N ' ' A' ' 46' ' ' HIS . 3.6 tpt180 -44.34 126.36 5.18 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.717 1.607 . . . . 0.0 110.994 -171.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.502 ' N ' ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -103.52 133.33 48.74 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.45 1.5 . . . . 0.0 111.355 -168.237 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HB3' ' CG1' ' A' ' 31' ' ' VAL . . . -43.15 138.23 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.401 1.48 . . . . 0.0 111.01 164.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 10.5 mt -52.73 161.97 0.66 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.49 1.516 . . . . 0.0 111.091 -163.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 49' ' ' ARG . 0.5 OUTLIER -34.26 -48.23 0.33 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.687 1.995 . . . . 0.0 111.404 160.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -19.97 66.01 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 126.216 1.806 . . . . 0.0 112.067 -163.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -104.47 -24.38 13.04 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.587 1.955 . . . . 0.0 111.027 178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.841 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -92.27 139.08 18.53 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 C-N-CA 126.607 1.963 . . . . 0.0 110.78 -173.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -140.69 157.57 45.24 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.749 1.62 . . . . 0.0 111.897 173.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.569 ' HE2' HG21 ' A' ' 16' ' ' VAL . 12.0 m-85 -112.69 142.03 45.77 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.522 1.529 . . . . 0.0 112.613 -161.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 11.0 m-85 -117.21 -178.44 3.45 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 129.336 3.054 . . . . 0.0 111.626 173.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.06 -45.43 27.1 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.522 1.529 . . . . 0.0 111.608 161.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.548 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 9.4 p30 -150.43 177.59 9.85 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.396 1.478 . . . . 0.0 111.345 -177.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.618 ' HB1' ' CZ ' ' A' ' 37' ' ' PHE . . . -78.89 -13.77 59.61 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.852 1.661 . . . . 0.0 111.458 -172.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.548 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -71.91 -38.8 69.86 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.247 1.819 . . . . 0.0 111.966 172.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.5 tp10 -63.17 -43.53 97.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.521 1.528 . . . . 0.0 109.83 167.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.543 ' CB ' ' CD2' ' A' ' 37' ' ' PHE . . . -68.34 -30.43 69.39 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.197 1.399 . . . . 0.0 110.947 176.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.463 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.93 -38.44 72.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.097 1.759 . . . . 0.0 110.617 168.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -56.37 -25.73 50.52 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.86 1.664 . . . . 0.0 111.012 165.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -86.96 -7.6 58.01 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.959 1.703 . . . . 0.0 111.717 175.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.12 -18.29 42.85 Favored Glycine 0 CA--C 1.547 2.079 0 C-N-CA 124.482 1.039 . . . . 0.0 113.08 173.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.777 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 13.0 m-30 -80.05 151.64 29.8 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.014 1.725 . . . . 0.0 111.563 -161.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.22 150.62 37.07 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 126.277 1.831 . . . . 0.0 111.429 177.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.415 ' HB2' ' HD3' ' A' ' 74' ' ' PRO . 21.2 Cg_endo -55.95 126.35 22.12 Favored 'Trans proline' 0 CA--C 1.549 1.252 0 C-N-CA 125.181 3.921 . . . . 0.0 115.638 175.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.3 t -56.82 142.83 39.46 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.847 2.459 . . . . 0.0 111.02 173.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.7 tttp -68.54 -3.52 11.94 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.001 2.121 . . . . 0.0 111.82 -170.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.591 ' CZ ' ' HD2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -126.82 -37.4 2.13 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 127.618 2.367 . . . . 0.0 112.474 -169.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 11.7 m -94.33 -57.26 2.55 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.666 2.387 . . . . 0.0 111.508 -162.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.769 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.61 -54.51 0.42 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.696 1.598 . . . . 0.0 111.192 -159.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.44 ' HG2' ' HB2' ' A' ' 76' ' ' LYS . 69.1 Cg_endo -78.64 -22.67 8.98 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.487 3.458 . . . . 0.0 112.729 167.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 68.2 55.75 0.53 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.776 1.63 . . . . 0.0 111.13 -164.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -105.01 36.38 2.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.522 1.129 . . . . 0.0 110.095 -163.11 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -76.0 168.17 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.667 1.587 . . . . 0.0 111.254 169.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 0.7 OUTLIER -154.33 178.43 1.63 Allowed Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.703 1.601 . . . . 0.0 110.899 -173.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.46 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 83.5 Cg_exo -46.72 104.96 0.07 OUTLIER 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.277 3.318 . . . . 0.0 112.424 164.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.477 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -38.4 -162.24 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 129.824 3.25 . . . . 0.0 116.897 172.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.477 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 3.2 tp60 5.15 84.5 0.01 OUTLIER 'General case' 0 C--N 1.363 1.167 0 C-N-CA 128.805 2.842 . . . . 0.0 112.589 -165.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.67 -26.23 5.76 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.604 1.562 . . . . 0.0 111.578 167.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 29.71 55.58 0.15 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.893 1.677 . . . . 0.0 110.761 -160.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -38.39 109.78 0.11 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.049 2.14 . . . . 0.0 111.89 -167.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -93.67 164.51 13.12 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.147 1.779 . . . . 0.0 111.422 -170.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 84.17 121.34 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.647 1.579 . . . . 0.0 110.701 163.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 mm 49.39 81.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.94 1.696 . . . . 0.0 109.003 164.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 t -61.87 -39.85 93.33 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.609 1.563 . . . . 0.0 110.074 -172.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -149.85 -83.08 0.1 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.585 1.554 . . . . 0.0 111.437 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -119.91 -84.14 0.66 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.594 1.558 . . . . 0.0 110.735 173.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 169.44 135.18 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.591 1.556 . . . . 0.0 110.406 -176.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 125.6 1.56 . . . . 0.0 110.138 176.497 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.545 0.753 0 N-CA-C 110.696 -0.113 . . . . 0.0 110.696 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt 65.52 63.37 0.63 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.538 1.535 . . . . 0.0 110.561 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.8 tptp -133.97 11.58 3.95 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.487 1.515 . . . . 0.0 111.004 -178.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.49 -98.93 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.401 1.48 . . . . 0.0 111.292 -173.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.4 HG23 ' O ' ' A' ' 5' ' ' THR . 13.8 t 30.97 49.94 0.09 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.467 1.907 . . . . 0.0 110.403 -166.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.97 -161.21 1.12 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.625 1.57 . . . . 0.0 110.391 -165.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.411 HD12 ' CZ ' ' A' ' 12' ' ' ARG . 2.2 mm? -89.43 23.3 2.6 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.382 1.873 . . . . 0.0 110.897 165.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.431 HG22 ' H ' ' A' ' 9' ' ' ASP . 3.0 m -59.68 168.43 1.68 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.452 1.901 . . . . 0.0 110.819 175.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' H ' HG22 ' A' ' 8' ' ' THR . 10.8 m-20 -62.33 -23.93 67.04 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.671 1.589 . . . . 0.0 111.42 -174.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -42.77 -75.98 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.431 1.492 . . . . 0.0 111.127 165.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.888 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -76.43 -18.82 58.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.276 1.03 . . . . 0.0 110.825 -169.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.522 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -43.89 -55.9 4.25 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 122.965 1.364 . . . . 0.0 109.879 160.043 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.747 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.8 t-105 -76.95 -15.22 59.73 Favored 'General case' 0 C--N 1.362 1.128 0 CA-C-N 114.527 -1.215 . . . . 0.0 112.181 177.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.888 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 9.6 mm100 -69.65 -50.93 39.46 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.078 0.854 . . . . 0.0 110.501 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.7 m -55.24 -38.68 68.8 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 125.154 1.382 . . . . 0.0 112.464 170.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.92 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.4 t -89.15 -27.5 5.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.117 1.767 . . . . 0.0 110.604 -170.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 19.4 mt -71.92 -45.81 59.86 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.096 1.358 . . . . 0.0 110.704 168.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.55 -15.7 20.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.946 1.698 . . . . 0.0 110.582 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 60.5 mtt180 72.19 30.36 2.11 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.906 1.682 . . . . 0.0 110.939 172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -69.23 94.07 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.643 1.577 . . . . 0.0 110.347 -162.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 37.5 Cg_exo -62.81 -14.69 42.25 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.116 3.211 . . . . 0.0 112.782 -163.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.72 17.65 23.41 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.377 1.871 . . . . 0.0 111.355 -164.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.735 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -103.1 20.86 16.83 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.451 1.5 . . . . 0.0 111.232 172.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.99 124.94 23.91 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.447 1.499 . . . . 0.0 111.184 163.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 90.35 -25.46 12.67 Favored Glycine 0 CA--C 1.543 1.821 0 C-N-CA 125.588 1.566 . . . . 0.0 112.049 -169.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -74.64 -36.7 62.89 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.63 1.572 . . . . 0.0 110.822 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.735 ' HE1' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -171.08 -177.6 2.23 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.479 1.112 . . . . 0.0 112.101 168.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.6 m -132.12 172.18 16.8 Favored 'Isoleucine or valine' 0 C--N 1.355 0.808 0 C-N-CA 126.007 1.723 . . . . 0.0 109.868 162.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.8 OUTLIER -139.68 155.06 47.6 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.817 1.247 . . . . 0.0 111.114 170.674 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.05 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -133.55 106.47 7.45 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.026 1.73 . . . . 0.0 111.77 -163.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.646 ' CG2' HG23 ' A' ' 52' ' ' VAL . 74.8 t -83.27 110.35 18.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.23 1.412 . . . . 0.0 110.04 175.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -20.7 63.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.599 1.56 . . . . 0.0 111.341 -170.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.435 HG22 ' CG1' ' A' ' 31' ' ' VAL . 12.4 t -91.52 -24.56 19.6 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.504 1.522 . . . . 0.0 110.768 -167.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.744 HG23 HG13 ' A' ' 36' ' ' ILE . 2.9 t -100.86 -22.71 14.74 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.621 1.569 . . . . 0.0 110.829 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.4 35.65 91.66 Favored Glycine 0 CA--C 1.543 1.793 0 C-N-CA 125.597 1.57 . . . . 0.0 112.044 -174.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.744 HG13 HG23 ' A' ' 34' ' ' THR . 9.2 mt -115.25 158.09 15.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 126.061 1.744 . . . . 0.0 110.173 171.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.848 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 51.6 p90 -129.0 148.27 50.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.183 1.793 . . . . 0.0 111.048 167.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.5 m -130.68 178.24 6.79 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 127.268 2.227 . . . . 0.0 111.477 -172.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.724 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.4 OUTLIER -84.98 158.54 58.66 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 126.35 1.86 . . . . 0.0 109.142 157.694 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.92 ' HA ' HG22 ' A' ' 16' ' ' VAL . 9.8 Cg_endo -40.24 -26.14 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.65 3.567 . . . . 0.0 115.74 174.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 6.0 t -88.3 18.43 4.43 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 126.357 1.863 . . . . 0.0 113.095 -160.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.2 t -67.39 92.1 0.28 Allowed 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.874 1.215 . . . . 0.0 110.441 -163.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -75.44 -20.28 58.95 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.236 1.814 . . . . 0.0 111.082 -164.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.26 149.67 19.57 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.33 1.452 . . . . 0.0 111.046 163.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.487 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -43.58 107.87 0.1 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.685 1.594 . . . . 0.0 111.09 -173.204 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 31.3 m170 -42.34 120.7 1.71 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.613 1.565 . . . . 0.0 111.391 -175.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -80.03 122.68 27.04 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.347 1.459 . . . . 0.0 110.93 162.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.2 mt -44.27 145.98 0.73 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.01 1.724 . . . . 0.0 110.872 -163.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.447 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -48.78 -33.74 10.94 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.44 1.496 . . . . 0.0 111.019 168.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.422 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 1.9 tp10 -72.6 -15.32 61.74 Favored 'General case' 0 C--N 1.352 0.701 0 C-N-CA 125.766 1.626 . . . . 0.0 111.997 -169.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -104.04 -20.72 13.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.489 1.916 . . . . 0.0 111.133 173.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.646 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -96.81 143.26 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.653 1.581 . . . . 0.0 110.068 -171.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -138.34 156.07 47.96 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 0.0 111.714 171.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.522 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 61.8 m-85 -112.76 130.65 56.0 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.66 1.584 . . . . 0.0 112.482 -160.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.05 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 37.8 m-85 -107.65 -179.69 3.98 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 129.256 3.022 . . . . 0.0 111.72 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -36.18 26.03 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.961 1.704 . . . . 0.0 111.534 165.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.518 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -160.52 -179.47 7.68 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.216 1.406 . . . . 0.0 111.854 -175.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.848 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.7 -23.96 45.29 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.491 1.916 . . . . 0.0 111.811 -167.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.9 OUTLIER -71.48 -31.21 66.87 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.854 1.662 . . . . 0.0 112.288 174.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -65.8 -45.64 81.63 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.766 1.626 . . . . 0.0 109.924 166.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.519 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -66.61 -31.01 71.42 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.286 1.434 . . . . 0.0 110.798 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -73.47 -41.3 63.33 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.327 1.851 . . . . 0.0 110.913 169.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.24 -22.46 41.33 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.798 1.639 . . . . 0.0 111.018 170.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.5 -16.2 49.63 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.679 1.591 . . . . 0.0 111.728 175.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.54 -19.07 22.2 Favored Glycine 0 CA--C 1.548 2.11 0 C-N-CA 124.662 1.125 . . . . 0.0 113.193 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.873 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -80.22 153.25 28.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.942 1.697 . . . . 0.0 111.416 -160.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 1.01 ' HG2' ' CD ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -105.0 157.28 34.56 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 126.275 1.83 . . . . 0.0 111.362 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 1.01 ' CD ' ' HG2' ' A' ' 67' ' ' ARG . 68.3 Cg_endo -67.74 120.1 7.11 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.526 3.484 . . . . 0.0 115.426 -179.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.535 ' HA ' HG21 ' A' ' 36' ' ' ILE . 34.6 t -47.93 150.66 1.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.038 2.135 . . . . 0.0 110.839 174.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.13 8.2 9.28 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.396 1.478 . . . . 0.0 111.035 -170.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 -45.92 0.99 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.562 1.945 . . . . 0.0 110.909 -165.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.9 m -103.63 -66.67 0.93 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.782 1.633 . . . . 0.0 111.389 -168.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.548 ' CG ' ' CE2' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -57.49 -50.88 85.63 Favored Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 124.498 1.119 . . . . 0.0 110.265 -163.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 94.7 Cg_endo -94.96 -96.24 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 125.067 3.845 . . . . 0.0 112.899 170.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 171.95 67.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 127.066 2.147 . . . . 0.0 110.473 162.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 19.1 mmmt -104.24 27.95 7.29 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.057 1.343 . . . . 0.0 110.4 -161.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -46.08 129.04 9.82 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.57 1.548 . . . . 0.0 111.271 168.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -125.66 80.91 65.81 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.631 1.572 . . . . 0.0 110.961 175.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -63.28 119.15 6.1 Favored 'Trans proline' 0 CA--C 1.546 1.107 0 C-N-CA 124.242 3.295 . . . . 0.0 112.461 164.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -21.96 -67.71 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 128.321 2.648 . . . . 0.0 112.732 -175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.425 ' HG2' ' H ' ' A' ' 83' ' ' ARG . 26.5 tt0 -19.27 131.88 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 127.813 2.445 . . . . 0.0 112.312 169.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -47.41 -30.46 3.33 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.459 1.504 . . . . 0.0 111.384 165.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.425 ' H ' ' HG2' ' A' ' 81' ' ' GLN . 10.2 tpt180 40.0 65.43 0.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.731 1.612 . . . . 0.0 111.134 -177.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 179.52 130.07 0.08 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.534 1.934 . . . . 0.0 111.951 -174.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -39.94 -73.96 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.547 1.539 . . . . 0.0 111.144 169.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 165.03 -52.87 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 110.25 176.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.0 OUTLIER 35.42 86.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 127.46 2.304 . . . . 0.0 109.49 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.9 p -50.86 -25.74 4.92 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.551 1.54 . . . . 0.0 110.08 -173.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -60.76 138.68 58.08 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.584 1.553 . . . . 0.0 111.448 174.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -151.94 27.11 0.62 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.538 1.535 . . . . 0.0 110.683 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.9 m 39.1 35.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.572 1.549 . . . . 0.0 110.381 -169.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.3 tpp180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.606 1.563 . . . . 0.0 110.136 178.414 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 33.02 84.03 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.648 1.979 . . . . 0.0 110.461 -170.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 75.55 136.8 0.06 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.711 1.604 . . . . 0.0 110.495 167.418 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 170.94 120.05 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.473 1.509 . . . . 0.0 111.413 176.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.664 ' HB ' HD23 ' A' ' 7' ' ' LEU . 6.1 p 51.31 90.57 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.197 1.799 . . . . 0.0 110.235 164.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.0 t -66.99 83.65 0.12 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.701 1.6 . . . . 0.0 110.477 165.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.664 HD23 ' HB ' ' A' ' 5' ' ' THR . 0.3 OUTLIER -89.84 19.79 4.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.449 1.9 . . . . 0.0 110.876 -171.709 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.4 p -50.5 145.19 6.79 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.332 1.853 . . . . 0.0 110.942 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.41 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.6 p30 -58.86 -18.41 32.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.711 1.604 . . . . 0.0 111.382 175.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -47.65 -73.04 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.638 1.575 . . . . 0.0 111.299 167.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' O ' ' HB2' ' A' ' 15' ' ' SER . 1.0 OUTLIER -77.87 -19.81 54.15 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.43 1.892 . . . . 0.0 111.123 -171.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.0 OUTLIER -42.69 -56.91 2.95 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.381 1.072 . . . . 0.0 109.35 157.258 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.837 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.3 t-105 -88.36 -22.59 23.73 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 114.073 -1.421 . . . . 0.0 113.457 177.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.53 ' CB ' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -73.31 -47.89 38.98 Favored 'General case' 0 N--CA 1.482 1.138 0 CA-C-N 120.875 1.67 . . . . 0.0 109.642 174.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.675 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -45.12 -60.48 2.08 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.822 0.849 . . . . 0.0 111.666 160.506 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.837 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.3 t -69.03 -30.25 46.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 126.198 1.799 . . . . 0.0 111.133 -169.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mt -70.17 -39.74 75.1 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.849 1.26 . . . . 0.0 110.573 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -57.94 -19.92 33.79 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.498 1.519 . . . . 0.0 110.463 170.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mtm105 67.7 44.66 1.6 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.403 1.481 . . . . 0.0 110.907 177.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.44 94.51 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 125.732 1.613 . . . . 0.0 110.361 -161.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 21.8 Cg_exo -66.49 -11.97 33.83 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.028 3.152 . . . . 0.0 112.778 -163.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.2 t30 -109.6 19.98 18.64 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.944 2.098 . . . . 0.0 110.993 -169.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.903 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -97.83 16.37 20.98 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.713 1.605 . . . . 0.0 111.258 175.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.4 OUTLIER -61.78 123.46 18.03 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.259 1.424 . . . . 0.0 110.968 163.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 96.5 -34.7 4.81 Favored Glycine 0 CA--C 1.542 1.767 0 C-N-CA 125.459 1.504 . . . . 0.0 112.172 -170.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' C ' ' HD1' ' A' ' 27' ' ' PHE . 8.2 tt0 -70.33 -35.95 73.94 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.427 1.491 . . . . 0.0 110.478 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -179.43 -179.15 0.52 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.844 1.258 . . . . 0.0 111.91 171.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.009 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.6 m -129.65 171.5 17.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 126.427 1.891 . . . . 0.0 109.452 160.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -138.62 151.99 47.73 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.73 1.212 . . . . 0.0 111.26 172.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.102 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -134.49 108.77 8.3 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.069 1.748 . . . . 0.0 111.754 -161.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.738 HG22 HG23 ' A' ' 52' ' ' VAL . 96.1 t -87.76 100.14 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 125.181 1.392 . . . . 0.0 110.025 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.531 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 0.0 OUTLIER -52.06 -27.77 15.0 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.614 1.566 . . . . 0.0 111.346 -174.018 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.737 HG22 HG12 ' A' ' 31' ' ' VAL . 5.1 t -82.99 -30.8 27.91 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 110.996 -162.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.886 HG23 HG13 ' A' ' 36' ' ' ILE . 1.7 t -100.18 -14.92 18.31 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 111.059 172.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 60.68 39.29 96.42 Favored Glycine 0 CA--C 1.543 1.807 0 C-N-CA 125.35 1.453 . . . . 0.0 111.681 -174.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.886 HG13 HG23 ' A' ' 34' ' ' THR . 25.5 mt -114.32 159.2 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 C-N-CA 126.066 1.747 . . . . 0.0 109.977 170.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.846 ' HE2' ' HB1' ' A' ' 58' ' ' ALA . 34.7 p90 -130.37 148.29 52.17 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.097 1.759 . . . . 0.0 111.014 167.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 72.9 m -128.93 171.35 12.4 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 127.14 2.176 . . . . 0.0 111.479 -169.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.626 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 25.9 ttm180 -90.15 145.74 33.49 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 126.771 2.029 . . . . 0.0 109.011 157.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.903 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 6.2 Cg_endo -44.27 -25.54 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.696 3.598 . . . . 0.0 115.144 -165.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.465 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -71.1 3.31 3.56 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 127.675 2.39 . . . . 0.0 113.623 -165.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.9 t -57.98 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 119.698 1.136 . . . . 0.0 110.61 -161.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.46 -49.95 67.21 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.257 1.823 . . . . 0.0 111.063 -175.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -40.94 150.18 0.08 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.59 1.556 . . . . 0.0 111.249 178.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -45.49 98.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.705 1.602 . . . . 0.0 111.068 -168.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 3.6 m170 -43.58 135.42 3.74 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.861 1.664 . . . . 0.0 111.582 -169.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -88.39 121.76 31.13 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.449 1.499 . . . . 0.0 110.813 160.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.0 mt -48.19 153.67 0.67 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.546 1.538 . . . . 0.0 110.921 -162.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.73 -40.21 1.26 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.656 1.582 . . . . 0.0 111.112 165.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -72.39 -20.66 61.4 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 125.727 1.611 . . . . 0.0 111.891 -165.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -101.02 -18.57 16.22 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.756 2.022 . . . . 0.0 111.206 174.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.738 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.44 142.48 14.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.613 1.565 . . . . 0.0 110.189 -174.091 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.6 p -139.87 156.84 46.51 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.486 1.514 . . . . 0.0 111.918 169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 41.1 m-85 -112.97 136.4 52.69 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.559 1.543 . . . . 0.0 112.349 -161.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.102 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 7.7 m-85 -106.7 179.61 4.22 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 128.686 2.794 . . . . 0.0 111.879 172.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.8 -42.77 49.0 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 126.044 1.737 . . . . 0.0 111.47 164.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' HA ' HG13 ' A' ' 28' ' ' VAL . 23.2 p30 -160.35 177.69 10.35 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.341 1.456 . . . . 0.0 111.375 -176.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.846 ' HB1' ' HE2' ' A' ' 37' ' ' PHE . . . -67.32 -28.99 68.44 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.211 1.804 . . . . 0.0 111.68 -167.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.0 t -70.04 -34.27 73.03 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.96 1.704 . . . . 0.0 112.034 -178.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.8 tt0 -64.81 -39.75 94.1 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.773 1.629 . . . . 0.0 109.98 170.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 55' ' ' TYR . . . -70.09 -35.34 74.1 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.935 1.694 . . . . 0.0 111.154 175.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -64.37 -37.25 86.86 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.352 1.861 . . . . 0.0 110.424 165.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.7 -23.52 67.19 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.438 1.895 . . . . 0.0 111.483 171.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -79.56 -17.6 53.62 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.495 1.518 . . . . 0.0 111.447 170.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 36.08 23.87 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.977 1.751 . . . . 0.0 112.008 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.849 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 22.5 m-30 -98.44 166.87 11.16 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.655 1.582 . . . . 0.0 110.933 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.458 ' H ' ' HG2' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -114.48 154.16 46.57 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.673 1.589 . . . . 0.0 111.41 176.405 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.451 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 4.7 Cg_exo -76.81 115.75 4.1 Favored 'Trans proline' 0 CA--C 1.545 1.05 1 C-N-CA 125.333 4.022 . . . . 0.0 115.034 -172.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 35.8 t -46.88 142.7 3.27 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.454 1.901 . . . . 0.0 110.672 175.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.7 ttmt -81.15 8.53 8.56 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.433 1.493 . . . . 0.0 111.083 -165.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.787 ' HD2' ' HD3' ' A' ' 43' ' ' ARG . 0.2 OUTLIER -129.85 -41.5 1.31 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.761 2.024 . . . . 0.0 111.366 -166.044 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.0 m -106.8 -68.09 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.49 1.916 . . . . 0.0 111.651 -172.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.505 ' NE2' ' HB2' ' A' ' 58' ' ' ALA . 0.1 OUTLIER -51.1 -48.99 83.77 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 125.09 1.356 . . . . 0.0 110.403 -164.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 62.9 Cg_endo -81.75 -33.9 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.062 0 C-N-CA 124.936 3.758 . . . . 0.0 113.379 165.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.8 t0 78.28 55.72 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.445 1.898 . . . . 0.0 111.032 -163.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.41 ' HG3' ' N ' ' A' ' 77' ' ' ALA . 6.3 tppt? -110.91 158.78 18.35 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.401 1.48 . . . . 0.0 110.222 -164.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.41 ' N ' ' HG3' ' A' ' 76' ' ' LYS . . . -79.73 171.85 14.58 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.597 1.559 . . . . 0.0 111.251 173.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -127.31 103.57 22.7 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.598 1.559 . . . . 0.0 110.987 172.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.36 -93.66 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.194 0 C-N-CA 124.209 3.273 . . . . 0.0 112.378 -172.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -18.79 -97.53 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 128.577 2.751 . . . . 0.0 113.136 -173.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -19.79 122.03 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.658 2.383 . . . . 0.0 112.114 166.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 31.4 p80 -155.17 128.88 8.58 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.225 1.41 . . . . 0.0 111.848 -178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -113.86 51.68 0.85 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.059 1.344 . . . . 0.0 110.186 160.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.66 HD23 ' N ' ' A' ' 85' ' ' ASP . 5.5 tt -41.63 145.74 0.28 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.994 2.117 . . . . 0.0 111.676 -162.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.66 ' N ' HD23 ' A' ' 84' ' ' LEU . 3.1 t0 -121.66 -53.11 2.0 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.386 1.474 . . . . 0.0 111.278 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 7.4 tptt 78.69 138.86 0.07 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.53 1.532 . . . . 0.0 110.5 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 pt -146.48 79.33 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.569 1.548 . . . . 0.0 108.938 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.427 HG23 ' CD2' ' A' ' 89' ' ' HIS . 6.0 t -67.77 139.87 56.65 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.631 1.572 . . . . 0.0 110.107 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.427 ' CD2' HG23 ' A' ' 88' ' ' THR . 39.2 m-70 75.19 67.27 0.07 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.628 1.571 . . . . 0.0 111.453 -172.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -44.56 103.99 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.618 1.567 . . . . 0.0 110.696 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 2.2 m -78.01 103.46 7.97 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.633 1.573 . . . . 0.0 110.368 -170.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.601 1.56 . . . . 0.0 110.134 176.61 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.2 mtt . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.707 -0.109 . . . . 0.0 110.707 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.39 34.71 5.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.595 1.558 . . . . 0.0 110.526 175.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 16.7 mmtp -60.95 -88.07 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.647 1.579 . . . . 0.0 110.495 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 160.34 35.62 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.579 1.552 . . . . 0.0 111.236 -166.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.63 -68.04 0.08 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.592 1.557 . . . . 0.0 110.083 -166.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 57.04 97.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.584 1.553 . . . . 0.0 110.394 -177.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.69 21.73 3.37 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.352 1.861 . . . . 0.0 110.852 -170.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 67.0 p -50.7 130.77 25.14 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.134 1.774 . . . . 0.0 110.763 175.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -58.0 -24.17 57.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.503 1.521 . . . . 0.0 111.326 -179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 14' ' ' GLN . 19.9 m-20 -43.32 -65.11 0.53 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.827 1.651 . . . . 0.0 111.441 171.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.029 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 1.4 pt20 -91.53 -20.66 21.46 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.241 1.816 . . . . 0.0 111.009 -168.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -43.74 -60.27 1.87 Allowed 'General case' 0 CA--C 1.557 1.213 0 CA-C-O 122.596 1.189 . . . . 0.0 109.081 156.303 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.791 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 10.9 t-105 -83.89 -24.51 30.77 Favored 'General case' 0 C--N 1.363 1.162 0 CA-C-N 113.437 -1.71 . . . . 0.0 112.562 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.029 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.14 -46.73 32.42 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 120.052 1.296 . . . . 0.0 109.814 178.147 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.8 t -47.37 -54.15 11.95 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.646 0.778 . . . . 0.0 111.776 160.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.791 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.2 t -72.5 -32.43 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 125.794 1.637 . . . . 0.0 110.967 -169.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' ND1' ' A' ' 46' ' ' HIS . 7.0 mt -70.62 -39.44 73.74 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.189 1.396 . . . . 0.0 110.488 177.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.97 64.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.921 1.688 . . . . 0.0 110.727 175.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 78.05 18.4 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.574 1.949 . . . . 0.0 111.072 -175.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -51.84 94.33 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.665 1.586 . . . . 0.0 110.787 -166.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -61.65 -26.67 80.45 Favored 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 124.305 3.336 . . . . 0.0 112.92 -165.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -89.66 11.83 18.65 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.316 1.847 . . . . 0.0 111.385 -165.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -97.96 17.02 19.22 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.376 1.47 . . . . 0.0 111.234 163.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 8.3 p-10 -55.59 107.84 0.37 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.313 1.445 . . . . 0.0 111.124 163.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.72 -18.01 57.95 Favored Glycine 0 CA--C 1.543 1.79 0 C-N-CA 125.647 1.594 . . . . 0.0 112.015 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -70.96 -30.92 67.34 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.694 1.597 . . . . 0.0 110.714 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.901 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 26.2 p90 -167.26 -177.9 3.86 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.907 1.283 . . . . 0.0 111.975 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.076 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -127.66 172.18 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.264 1.826 . . . . 0.0 109.606 161.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HD1' HG22 ' A' ' 52' ' ' VAL . 27.8 p90 -141.53 149.49 40.91 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.423 1.089 . . . . 0.0 111.385 169.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.847 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.76 113.47 13.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.581 1.953 . . . . 0.0 111.207 -163.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.894 HG22 HG23 ' A' ' 52' ' ' VAL . 70.2 t -94.63 98.22 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 125.244 1.418 . . . . 0.0 110.067 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -49.89 -27.44 5.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.596 1.558 . . . . 0.0 111.314 -167.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.736 HG22 HG12 ' A' ' 31' ' ' VAL . 3.0 t -77.42 -32.6 54.77 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.643 1.577 . . . . 0.0 110.856 -163.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.667 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.5 t -101.58 -7.69 22.52 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.754 1.622 . . . . 0.0 111.229 166.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.84 35.2 5.93 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 126.284 1.897 . . . . 0.0 109.002 -174.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.667 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -90.9 161.41 2.59 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 C-N-CA 125.975 1.71 . . . . 0.0 109.924 167.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.865 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -134.68 156.91 47.95 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.181 1.392 . . . . 0.0 111.429 168.681 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.4 m -139.23 172.74 12.39 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.668 2.387 . . . . 0.0 110.848 -168.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.634 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 1.3 ttt180 -91.96 155.42 43.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 126.218 1.807 . . . . 0.0 109.284 158.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.901 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 9.4 Cg_endo -48.69 -21.07 3.18 Favored 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.553 3.502 . . . . 0.0 115.36 -168.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 19.33 5.11 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.955 1.702 . . . . 0.0 112.305 -161.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.8 t -63.75 100.64 0.3 Allowed 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 119.524 1.057 . . . . 0.0 110.521 -163.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -69.75 -50.97 38.24 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.916 1.687 . . . . 0.0 111.177 -163.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.783 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.2 131.42 12.92 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.51 1.524 . . . . 0.0 111.128 167.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -45.88 124.06 4.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.689 1.595 . . . . 0.0 111.05 -166.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.441 ' ND1' HD23 ' A' ' 17' ' ' LEU . 0.4 OUTLIER -71.7 144.63 49.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.463 1.505 . . . . 0.0 111.517 -165.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.477 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.42 127.61 33.19 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.328 1.451 . . . . 0.0 110.658 161.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -51.6 158.53 0.91 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.468 1.507 . . . . 0.0 110.946 -162.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.501 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -54.82 -28.73 51.67 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.6 . . . . 0.0 111.165 173.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -68.45 -19.27 64.56 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 125.743 1.617 . . . . 0.0 111.888 -173.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -110.41 -14.42 14.12 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.967 2.107 . . . . 0.0 111.281 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.894 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -98.64 140.58 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 125.583 1.553 . . . . 0.0 109.989 -171.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.3 p -137.45 155.92 48.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.26 1.424 . . . . 0.0 111.751 172.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.84 129.5 55.69 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.686 1.595 . . . . 0.0 112.283 -160.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.076 ' HB2' HG22 ' A' ' 28' ' ' VAL . 8.1 m-85 -107.62 179.28 4.28 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 128.973 2.909 . . . . 0.0 111.835 175.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.68 -45.06 31.12 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.974 1.709 . . . . 0.0 111.273 163.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.535 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 7.7 p30 -154.5 176.59 12.18 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.993 1.317 . . . . 0.0 111.601 -173.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.865 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.36 -2.5 38.47 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.775 1.63 . . . . 0.0 111.712 -174.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.535 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 13.8 m -82.39 -40.14 21.71 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.867 1.667 . . . . 0.0 112.496 171.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.681 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.61 -40.87 98.31 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.334 1.454 . . . . 0.0 109.754 171.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . . . -78.17 -25.83 47.39 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 124.807 1.243 . . . . 0.0 111.212 178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -66.55 -38.39 87.0 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.991 1.316 . . . . 0.0 110.449 161.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.72 -24.77 67.01 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.914 1.686 . . . . 0.0 111.459 171.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.94 -15.83 55.18 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.439 1.496 . . . . 0.0 111.702 169.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.43 49.72 11.17 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 125.714 1.626 . . . . 0.0 112.176 -178.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.812 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 21.1 m-30 -111.84 162.09 15.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.388 1.475 . . . . 0.0 110.977 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.21 151.84 43.39 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.542 1.537 . . . . 0.0 111.485 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.498 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.6 Cg_exo -79.69 112.97 3.0 Favored 'Trans proline' 0 CA--C 1.548 1.187 1 C-N-CA 125.635 4.223 . . . . 0.0 115.326 -167.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 22.5 t -43.28 153.61 0.1 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.369 2.268 . . . . 0.0 111.078 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HG3' ' HB2' ' A' ' 76' ' ' LYS . 5.3 tttm -82.95 9.15 10.69 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.915 2.086 . . . . 0.0 110.2 -170.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.51 -51.08 0.74 Allowed 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 126.201 1.8 . . . . 0.0 111.164 -162.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -103.01 -62.43 1.28 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.872 1.669 . . . . 0.0 111.157 -169.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.498 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -72.77 125.46 91.17 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 125.378 1.471 . . . . 0.0 110.147 176.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -33.34 91.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.076 1 C-N-CA 125.451 4.1 . . . . 0.0 113.768 177.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -148.6 -70.05 0.22 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.059 1.744 . . . . 0.0 111.156 -172.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.459 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -114.86 77.24 1.05 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.141 1.376 . . . . 0.0 110.021 165.854 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -75.29 175.48 8.31 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.156 1.782 . . . . 0.0 111.266 164.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.451 ' HA ' ' HD3' ' A' ' 79' ' ' PRO . 0.0 OUTLIER -34.08 135.09 0.36 Allowed Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 126.829 2.052 . . . . 0.0 111.543 178.121 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 78' ' ' ASN . 32.5 Cg_exo -62.41 113.56 1.98 Allowed 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 124.748 3.632 . . . . 0.0 112.445 -166.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -21.41 -72.5 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 127.602 2.361 . . . . 0.0 112.345 168.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 64.31 47.82 3.02 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.006 1.723 . . . . 0.0 111.13 176.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.0 p-80 46.48 95.76 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.478 1.911 . . . . 0.0 111.819 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -83.83 55.15 3.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.258 1.023 . . . . 0.0 110.393 161.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.416 ' C ' ' CD2' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -39.71 114.97 0.47 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.029 2.132 . . . . 0.0 111.609 -170.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.26 -81.56 0.63 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.609 1.564 . . . . 0.0 111.25 -177.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 1.5 ptpt 157.16 -179.76 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.138 1.775 . . . . 0.0 110.44 -164.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.4 mt 64.54 85.52 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.558 1.543 . . . . 0.0 108.978 -165.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.3 p -82.95 100.48 10.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.573 1.549 . . . . 0.0 110.092 -164.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.5 m170 50.04 33.18 6.53 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.623 1.569 . . . . 0.0 111.457 165.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.83 -175.65 5.54 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.585 1.554 . . . . 0.0 110.744 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 28.7 m -117.04 -28.77 6.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.678 1.591 . . . . 0.0 110.382 171.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 125.634 1.574 . . . . 0.0 110.17 170.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtp . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.738 -0.097 . . . . 0.0 110.738 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -129.23 133.29 47.46 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.614 1.566 . . . . 0.0 110.497 -174.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 pttp -102.67 -170.61 1.83 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.566 1.546 . . . . 0.0 110.466 167.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.03 92.92 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.614 1.566 . . . . 0.0 111.249 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.72 140.25 37.86 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.554 1.542 . . . . 0.0 110.055 172.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.871 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.7 OUTLIER -94.28 166.85 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.552 1.541 . . . . 0.0 110.307 166.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -89.67 20.52 3.98 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 126.386 1.874 . . . . 0.0 110.847 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.871 HG23 ' HB3' ' A' ' 6' ' ' CYS . 49.7 p -51.68 134.04 30.47 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.092 1.757 . . . . 0.0 110.851 -177.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.416 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 5.9 p30 -59.15 -17.92 31.37 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.413 1.485 . . . . 0.0 111.388 -173.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -47.64 -78.19 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.511 1.525 . . . . 0.0 111.012 170.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.084 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -78.12 -16.8 57.64 Favored 'General case' 0 C--N 1.352 0.683 0 C-N-CA 124.115 0.966 . . . . 0.0 110.623 -172.105 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.466 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 8.7 mmp_? -45.58 -57.48 4.14 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-O 122.793 1.282 . . . . 0.0 109.371 160.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.708 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 31.7 t-105 -71.55 -18.21 62.27 Favored 'General case' 0 C--N 1.363 1.16 0 CA-C-N 113.994 -1.457 . . . . 0.0 111.653 177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.084 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -67.77 -53.95 23.08 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 118.438 0.563 . . . . 0.0 110.537 170.051 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.534 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 5.6 m -52.46 -36.69 55.27 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.756 1.222 . . . . 0.0 111.956 171.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' A' ' 29' ' ' PHE . 2.1 t -90.01 -28.83 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 C-N-CA 126.474 1.91 . . . . 0.0 110.337 -169.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.485 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 5.2 mt -71.86 -39.78 69.43 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.416 1.487 . . . . 0.0 110.781 172.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.32 -21.93 51.14 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.504 1.522 . . . . 0.0 110.541 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.539 ' HD3' ' O ' ' A' ' 41' ' ' SER . 0.2 OUTLIER 76.76 17.1 1.82 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.267 1.827 . . . . 0.0 111.026 -177.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -53.4 94.48 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.905 1.682 . . . . 0.0 110.948 -164.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.442 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 53.0 Cg_endo -63.08 -28.21 74.05 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.208 3.272 . . . . 0.0 112.776 -170.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -76.21 -1.03 24.4 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 127.216 2.206 . . . . 0.0 111.411 -169.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.626 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.42 9.79 19.59 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.506 1.522 . . . . 0.0 111.112 172.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.465 ' CB ' ' HD3' ' A' ' 39' ' ' ARG . 5.6 t70 -41.21 113.51 0.4 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.467 1.507 . . . . 0.0 111.191 161.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.81 -16.37 37.09 Favored Glycine 0 CA--C 1.543 1.822 0 C-N-CA 125.66 1.6 . . . . 0.0 112.09 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.45 -29.59 67.32 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.821 1.648 . . . . 0.0 110.664 171.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.962 ' CE2' ' HB3' ' A' ' 40' ' ' PRO . 20.6 p90 -167.86 -176.58 3.11 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.737 1.215 . . . . 0.0 111.946 166.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.948 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.9 m -130.8 173.09 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.206 1.802 . . . . 0.0 109.425 160.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.726 ' HE2' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -142.0 159.62 41.86 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.142 0.977 . . . . 0.0 111.504 165.435 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.798 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -137.57 118.66 14.42 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.707 2.003 . . . . 0.0 111.179 -163.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' ' 47' ' ' ALA . 94.2 t -90.68 102.25 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.271 1.428 . . . . 0.0 110.09 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.35 -23.95 52.14 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.686 1.594 . . . . 0.0 111.294 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -83.04 -26.23 31.37 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.79 -164.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.457 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.8 t -100.89 -27.03 13.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.603 1.561 . . . . 0.0 110.821 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.97 58.03 7.98 Favored Glycine 0 CA--C 1.543 1.843 0 C-N-CA 125.457 1.503 . . . . 0.0 111.425 -163.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.457 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 20.2 mt -131.89 150.65 34.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 126.216 1.806 . . . . 0.0 110.022 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.911 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -135.98 140.1 43.68 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.507 1.523 . . . . 0.0 111.285 167.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 24.9 m -121.75 179.58 4.44 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 127.164 2.185 . . . . 0.0 111.94 -178.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.465 ' HD3' ' CB ' ' A' ' 24' ' ' ASP . 1.7 ttm180 -84.28 154.39 63.11 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 126.141 1.776 . . . . 0.0 109.063 156.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.962 ' HB3' ' CE2' ' A' ' 27' ' ' PHE . 9.1 Cg_endo -46.44 -22.65 1.77 Allowed 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 124.505 3.47 . . . . 0.0 115.328 -170.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.539 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -84.68 11.88 8.18 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 127.118 2.167 . . . . 0.0 113.268 -160.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.6 t -55.56 111.75 0.97 Allowed 'General case' 0 N--CA 1.478 0.938 0 O-C-N 120.967 -1.083 . . . . 0.0 110.663 -160.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 -46.78 22.2 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.779 2.032 . . . . 0.0 111.067 -175.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -46.1 144.36 1.95 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.647 1.579 . . . . 0.0 111.194 173.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.15 108.57 0.15 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.517 1.527 . . . . 0.0 111.057 -166.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.84 135.42 7.07 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.763 1.625 . . . . 0.0 111.546 -168.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -87.13 127.33 35.14 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.51 1.524 . . . . 0.0 110.973 161.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.78 150.56 0.7 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.639 1.575 . . . . 0.0 110.883 -163.254 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -41.52 -33.22 0.42 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.316 1.846 . . . . 0.0 110.959 165.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -82.71 -21.5 34.81 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 126.498 1.919 . . . . 0.0 111.804 -165.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -94.0 -19.08 21.22 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.39 1.876 . . . . 0.0 111.078 170.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.613 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -98.17 139.98 19.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.423 1.489 . . . . 0.0 110.126 -164.61 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.8 p -139.3 157.78 45.3 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.804 1.642 . . . . 0.0 111.709 173.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.449 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 54.6 m-85 -117.83 131.01 56.61 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.63 1.572 . . . . 0.0 112.064 -162.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.948 ' HB2' HG22 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -112.97 179.14 4.05 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 129.37 3.068 . . . . 0.0 111.416 176.048 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.91 -36.16 42.39 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.086 1.754 . . . . 0.0 111.583 167.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.757 ' HA ' HG13 ' A' ' 28' ' ' VAL . 13.9 p30 -165.86 179.49 5.87 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.358 1.463 . . . . 0.0 111.553 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.911 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.52 -34.66 47.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 126.19 1.796 . . . . 0.0 111.641 -167.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.719 ' HA ' HD12 ' A' ' 62' ' ' LEU . 1.4 t -64.9 -16.08 62.81 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.769 1.628 . . . . 0.0 111.215 174.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.665 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.0 OUTLIER -77.11 -48.62 17.27 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.992 1.717 . . . . 0.0 110.873 166.016 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.33 66.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.818 1.647 . . . . 0.0 111.053 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.719 HD12 ' HA ' ' A' ' 59' ' ' SER . 18.4 mt -67.54 -47.88 68.59 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.087 2.155 . . . . 0.0 110.407 166.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.77 -27.43 64.97 Favored 'General case' 0 C--N 1.354 0.8 0 C-N-CA 126.342 1.857 . . . . 0.0 111.443 174.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.15 -14.83 57.25 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.426 1.491 . . . . 0.0 111.565 173.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.47 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 77.38 50.57 6.59 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.898 1.713 . . . . 0.0 112.04 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.798 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 4.2 m-30 -111.79 171.84 7.26 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.666 1.586 . . . . 0.0 110.906 176.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -116.62 145.52 35.53 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 126.054 1.742 . . . . 0.0 111.385 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.457 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.0 Cg_endo -66.07 120.71 7.91 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 124.46 3.44 . . . . 0.0 115.255 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.453 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.5 t -50.04 152.22 1.72 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.5 1.92 . . . . 0.0 110.829 179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 12.6 ttmt -82.16 9.3 8.9 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.499 1.52 . . . . 0.0 110.962 -170.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.19 -47.34 0.78 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.587 1.955 . . . . 0.0 111.074 -163.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 5.0 m -105.52 -60.68 1.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.547 1.939 . . . . 0.0 111.199 -165.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.529 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -75.8 107.38 4.21 Favored Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.168 1.387 . . . . 0.0 110.151 175.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -32.58 88.21 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.168 1 C-N-CA 126.239 4.626 . . . . 0.0 114.307 -163.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.418 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 42.1 t0 -129.86 -62.63 0.95 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.394 1.878 . . . . 0.0 111.098 -178.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.2 tppt? -135.65 131.76 36.17 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.044 1.338 . . . . 0.0 110.383 163.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.93 170.18 12.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.637 1.575 . . . . 0.0 111.264 166.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -61.41 120.57 56.66 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.729 1.612 . . . . 0.0 111.007 -176.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -72.59 150.01 50.37 Favored 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.372 3.381 . . . . 0.0 112.724 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.406 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 8.0 ttm180 24.72 -106.63 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.312 2.245 . . . . 0.0 112.139 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.406 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 4.8 tt0 66.26 85.3 0.14 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.908 1.683 . . . . 0.0 110.974 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -127.51 -43.98 1.56 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.611 1.564 . . . . 0.0 111.365 164.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.0 mtm-85 37.65 76.17 0.06 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.651 1.58 . . . . 0.0 111.087 -169.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 tt 179.51 114.63 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.521 1.928 . . . . 0.0 111.939 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.02 -52.33 36.8 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.665 1.586 . . . . 0.0 111.212 -177.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 166.48 126.55 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.039 1.736 . . . . 0.0 110.452 -169.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.9 tt -65.52 131.44 31.3 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.624 1.57 . . . . 0.0 108.965 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 22.0 p -84.73 173.06 10.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.596 1.559 . . . . 0.0 110.048 -175.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 78.4 m80 60.34 30.28 19.69 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.625 1.57 . . . . 0.0 111.43 174.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -88.56 -169.71 2.65 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.591 1.556 . . . . 0.0 110.676 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 t -95.23 -45.95 6.96 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.578 1.551 . . . . 0.0 110.337 174.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.579 1.552 . . . . 0.0 110.166 171.642 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.722 0 N-CA-C 110.703 -0.11 . . . . 0.0 110.703 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.7 mtmm -128.66 172.47 11.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.57 1.548 . . . . 0.0 110.503 -172.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.0 pttm -71.37 151.39 44.14 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.612 1.565 . . . . 0.0 110.5 -167.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.602 ' C ' HG22 ' A' ' 5' ' ' THR . . . 71.39 152.44 0.11 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.6 1.56 . . . . 0.0 111.249 170.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.602 HG22 ' C ' ' A' ' 4' ' ' ALA . 0.0 OUTLIER 168.49 136.4 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.583 1.553 . . . . 0.0 110.057 -172.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t 76.59 48.03 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.601 1.56 . . . . 0.0 110.37 168.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.82 HD12 HH21 ' A' ' 12' ' ' ARG . 2.0 mm? -89.67 18.99 4.94 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.449 1.899 . . . . 0.0 110.901 171.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 53.2 p -48.65 151.98 1.06 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.23 1.812 . . . . 0.0 110.848 -173.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 6.1 p-10 -57.42 -16.92 10.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.523 1.529 . . . . 0.0 111.349 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -47.77 -78.69 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 111.187 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.956 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.2 tt0 -74.38 -20.8 59.94 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 124.194 0.997 . . . . 0.0 110.616 -170.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.82 HH21 HD12 ' A' ' 7' ' ' LEU . 13.1 mmt85 -41.94 -58.57 2.01 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-O 123.089 1.423 . . . . 0.0 109.944 160.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.697 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 29.1 t-105 -71.87 -19.3 61.97 Favored 'General case' 0 C--N 1.364 1.238 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.719 176.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.956 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -65.5 -56.13 14.08 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 118.589 0.631 . . . . 0.0 110.491 171.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.7 t -58.75 -29.57 66.85 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 124.589 1.156 . . . . 0.0 112.568 174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.873 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.3 t -89.69 -27.76 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.301 1.84 . . . . 0.0 110.451 -175.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 14.2 mt -75.84 -42.8 48.61 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.395 1.478 . . . . 0.0 110.563 169.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.69 -9.82 10.45 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.401 1.881 . . . . 0.0 110.82 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.71 20.45 11.37 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.869 1.667 . . . . 0.0 110.99 171.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -56.84 92.36 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 125.728 1.611 . . . . 0.0 110.547 -175.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -64.61 -11.93 31.22 Favored 'Trans proline' 0 CA--C 1.546 1.077 0 C-N-CA 124.245 3.297 . . . . 0.0 113.27 -163.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -103.44 19.25 20.08 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.408 1.883 . . . . 0.0 111.158 -166.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.842 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -104.03 21.27 16.72 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.337 1.455 . . . . 0.0 111.266 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB2' ' CD ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -72.19 125.72 28.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.438 1.495 . . . . 0.0 111.181 163.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 95.53 -28.86 10.76 Favored Glycine 0 CA--C 1.544 1.861 0 C-N-CA 125.628 1.585 . . . . 0.0 112.079 -166.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.17 -41.96 60.66 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.712 1.605 . . . . 0.0 110.807 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.797 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -169.26 -176.41 2.54 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.131 1.372 . . . . 0.0 111.621 169.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.039 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.8 m -127.82 172.23 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 126.446 1.898 . . . . 0.0 109.697 161.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.68 ' HD1' HG22 ' A' ' 52' ' ' VAL . 7.7 p90 -137.83 143.27 40.91 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.712 1.205 . . . . 0.0 111.124 168.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -130.94 118.38 20.6 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.064 1.745 . . . . 0.0 111.677 -161.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.846 HG22 HG23 ' A' ' 52' ' ' VAL . 67.0 t -99.96 103.86 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.213 1.405 . . . . 0.0 110.07 -175.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 15.1 mmm-85 -56.35 -26.47 52.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.727 1.611 . . . . 0.0 111.409 -169.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.624 HG22 HG12 ' A' ' 31' ' ' VAL . 6.4 t -82.92 -31.38 27.78 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.547 1.539 . . . . 0.0 111.14 -161.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.674 HG23 HG13 ' A' ' 36' ' ' ILE . 4.1 t -100.08 -15.97 18.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.685 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 64.51 38.72 96.11 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 125.405 1.478 . . . . 0.0 111.765 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.705 HG21 ' HA ' ' A' ' 69' ' ' CYS . 39.6 mt -110.91 164.08 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.909 1.683 . . . . 0.0 110.022 171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.896 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 20.7 p90 -129.12 158.66 38.35 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.721 1.608 . . . . 0.0 111.075 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 87.5 m -140.3 172.42 12.77 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.539 2.336 . . . . 0.0 110.826 -164.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.776 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 21.5 ttm180 -89.86 156.59 46.99 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 127.008 2.123 . . . . 0.0 109.065 158.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.873 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.0 Cg_endo -41.63 -23.39 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.694 3.596 . . . . 0.0 116.196 176.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.18 15.24 10.67 Favored 'General case' 0 C--O 1.244 0.788 0 C-N-CA 125.979 1.712 . . . . 0.0 112.561 -160.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -61.03 101.34 0.15 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 119.719 1.145 . . . . 0.0 110.456 -161.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.801 ' HG3' ' H ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -62.38 -50.49 71.37 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.096 1.758 . . . . 0.0 111.245 -163.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.801 ' H ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.01 133.61 22.55 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.062 174.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.578 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 1.1 ptp85 -43.84 110.29 0.2 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.518 1.527 . . . . 0.0 110.803 -174.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -56.53 143.94 33.45 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.598 1.559 . . . . 0.0 111.786 -161.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.16 130.92 37.97 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.415 1.486 . . . . 0.0 110.53 160.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -44.9 149.2 0.46 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.812 1.645 . . . . 0.0 111.471 -161.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 1.5 tmm_? -47.61 -29.29 2.81 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.425 1.89 . . . . 0.0 111.579 165.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -75.83 -20.03 58.46 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 125.777 1.631 . . . . 0.0 112.274 -170.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -107.43 6.55 28.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.297 1.839 . . . . 0.0 111.399 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.846 HG23 HG22 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -120.98 133.65 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.3 1.84 . . . . 0.0 109.924 -166.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.8 p -136.37 156.07 49.15 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.97 1.308 . . . . 0.0 112.008 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.472 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 60.5 m-85 -116.84 133.96 55.36 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.634 1.574 . . . . 0.0 112.216 -160.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.039 ' HB2' HG22 ' A' ' 28' ' ' VAL . 6.4 m-85 -113.13 -179.38 3.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 128.782 2.833 . . . . 0.0 111.923 176.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.66 58.1 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 125.834 1.654 . . . . 0.0 111.361 163.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.639 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 5.3 p30 -160.15 178.06 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.56 1.544 . . . . 0.0 111.279 -169.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.896 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.53 -13.55 59.47 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.842 1.657 . . . . 0.0 111.445 -172.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.639 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 25.1 t -71.78 -37.54 70.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.896 1.679 . . . . 0.0 112.191 171.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.686 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 13.7 tp10 -61.08 -42.65 98.9 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.809 1.643 . . . . 0.0 109.863 168.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.81 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -74.68 -30.25 61.5 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.338 1.455 . . . . 0.0 111.057 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.8 mt -65.9 -38.93 90.01 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.617 1.567 . . . . 0.0 110.505 162.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.59 -27.51 67.77 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.09 1.756 . . . . 0.0 111.536 174.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.63 ' HB3' ' CD2' ' A' ' 66' ' ' PHE . . . -82.64 -14.99 53.75 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.436 1.495 . . . . 0.0 111.614 174.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.7 49.81 6.93 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.732 1.634 . . . . 0.0 112.113 -175.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.685 ' HD1' ' C ' ' A' ' 35' ' ' GLY . 97.8 m-85 -108.99 161.65 14.96 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.669 1.588 . . . . 0.0 110.864 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.89 156.09 36.13 Favored Pre-proline 0 CA--C 1.55 0.964 0 C-N-CA 125.78 1.632 . . . . 0.0 111.318 176.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.44 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -76.84 115.09 3.96 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 125.067 3.844 . . . . 0.0 115.038 -176.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.705 ' HA ' HG21 ' A' ' 36' ' ' ILE . 23.4 t -44.38 152.22 0.21 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.606 1.962 . . . . 0.0 111.061 -172.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tppp? -69.76 -7.73 42.03 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.377 1.871 . . . . 0.0 110.879 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.44 -44.98 1.36 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.943 1.697 . . . . 0.0 110.925 -162.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 19.2 m -95.01 -60.56 1.66 Allowed 'General case' 0 C--N 1.353 0.72 0 C-N-CA 124.702 1.201 . . . . 0.0 111.422 -165.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.614 ' CG ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -72.53 -52.11 6.77 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.201 1.0 . . . . 0.0 110.486 -161.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.493 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 54.7 Cg_endo -87.43 -29.17 0.39 Allowed 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 124.592 3.528 . . . . 0.0 113.631 172.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 73.76 56.1 0.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.716 1.606 . . . . 0.0 111.052 -162.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.464 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 0.3 OUTLIER -100.28 26.91 6.08 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.221 1.409 . . . . 0.0 110.569 -162.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -63.16 84.73 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.539 1.535 . . . . 0.0 111.351 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 t30 162.21 93.82 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 110.917 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 -107.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 124.13 3.22 . . . . 0.0 112.248 -166.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -30.09 -72.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 127.601 2.36 . . . . 0.0 112.799 -162.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -27.55 143.67 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.609 2.364 . . . . 0.0 112.356 171.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m170 -107.79 -46.14 3.86 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.217 1.407 . . . . 0.0 111.706 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 21.68 59.87 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 126.778 2.031 . . . . 0.0 111.211 -160.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.936 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.5 OUTLIER -34.33 140.9 0.06 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.351 2.26 . . . . 0.0 111.731 -177.277 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.936 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.5 OUTLIER -121.63 147.08 46.32 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.502 1.521 . . . . 0.0 111.285 172.507 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 172.31 -76.13 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.694 1.998 . . . . 0.0 110.294 -171.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.8 mm 65.03 97.12 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.616 1.566 . . . . 0.0 108.997 -177.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 t -61.05 154.49 22.63 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.584 1.554 . . . . 0.0 110.085 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -61.82 116.64 5.0 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.566 1.546 . . . . 0.0 111.44 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.93 71.5 0.47 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.61 1.564 . . . . 0.0 110.731 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -50.6 7.83 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.626 1.57 . . . . 0.0 110.358 -174.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.548 0 C-N-CA 125.589 1.555 . . . . 0.0 110.155 -173.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mtp . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -126.27 63.08 1.26 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.581 1.552 . . . . 0.0 110.512 173.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.3 OUTLIER -77.66 -42.41 34.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.601 1.56 . . . . 0.0 110.532 179.151 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 81.12 120.06 0.05 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.631 1.572 . . . . 0.0 111.26 172.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.6 m -127.61 101.7 6.52 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.015 -178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.53 ' SG ' HG23 ' A' ' 8' ' ' THR . 6.7 t 78.12 140.06 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.621 1.569 . . . . 0.0 110.402 175.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.467 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.65 19.14 4.83 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.385 1.874 . . . . 0.0 110.914 -170.218 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.53 HG23 ' SG ' ' A' ' 6' ' ' CYS . 31.3 p -45.59 128.69 8.5 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.173 1.789 . . . . 0.0 110.809 -174.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.477 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 7.2 m-20 -64.35 -18.22 64.44 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.455 1.502 . . . . 0.0 111.333 -169.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -46.1 -77.44 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.492 1.517 . . . . 0.0 111.114 167.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.937 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.1 mt-30 -77.98 -20.49 52.53 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 124.007 0.923 . . . . 0.0 110.393 -170.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.467 ' NH1' HD13 ' A' ' 7' ' ' LEU . 1.1 mmp_? -42.55 -59.46 1.88 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 123.196 1.474 . . . . 0.0 109.875 160.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.2 t-105 -70.02 -19.13 63.32 Favored 'General case' 0 C--N 1.364 1.215 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.649 176.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.937 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -68.11 -55.7 11.51 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 118.458 0.572 . . . . 0.0 110.526 172.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.5 m -52.79 -33.78 50.43 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.8 1.24 . . . . 0.0 112.227 171.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.78 -27.97 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 126.349 1.86 . . . . 0.0 110.541 -173.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.459 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 8.6 mt -75.58 -38.33 59.23 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.15 1.38 . . . . 0.0 110.695 172.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.34 -19.29 34.1 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.78 1.632 . . . . 0.0 110.521 170.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 74.46 17.19 3.15 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.26 1.824 . . . . 0.0 111.086 176.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.29 88.57 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.831 1.653 . . . . 0.0 110.789 -164.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 19.4 Cg_exo -62.91 -14.71 42.84 Favored 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 124.268 3.312 . . . . 0.0 112.658 -168.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -79.6 -5.77 55.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.902 2.081 . . . . 0.0 111.427 -174.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -89.83 12.41 17.33 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.683 1.593 . . . . 0.0 111.095 -174.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 15.1 p-10 -51.44 113.9 1.09 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.305 1.442 . . . . 0.0 111.076 161.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 100.75 -29.01 13.34 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.603 1.573 . . . . 0.0 112.079 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.489 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.5 OUTLIER -69.57 -39.69 77.21 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.017 1.727 . . . . 0.0 110.494 -176.375 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' N ' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -164.96 -177.28 4.58 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.205 1.402 . . . . 0.0 111.491 170.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.015 HG22 ' HB2' ' A' ' 55' ' ' TYR . 4.9 m -125.18 173.31 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.267 1.827 . . . . 0.0 109.75 161.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.497 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -137.12 150.54 48.05 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.599 1.159 . . . . 0.0 110.924 163.391 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -136.33 108.47 7.23 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.079 1.752 . . . . 0.0 111.63 -161.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.993 HG12 HG22 ' A' ' 33' ' ' THR . 46.6 t -89.03 107.38 17.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.342 1.457 . . . . 0.0 110.117 -179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 51' ' ' ASN . 6.4 ptp180 -58.87 -19.71 44.46 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.47 1.508 . . . . 0.0 111.349 -172.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.993 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -81.38 -37.3 28.42 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.508 1.523 . . . . 0.0 110.766 -168.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.602 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -100.93 -5.51 25.88 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.726 1.61 . . . . 0.0 111.259 170.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.11 34.49 4.31 Favored Glycine 0 N--CA 1.495 2.598 0 C-N-CA 126.127 1.823 . . . . 0.0 108.944 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.602 ' H ' HG23 ' A' ' 34' ' ' THR . 44.0 mt -96.5 157.33 3.26 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 C-N-CA 125.838 1.655 . . . . 0.0 109.881 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.824 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 26.0 p90 -132.11 154.19 49.73 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.531 1.533 . . . . 0.0 111.046 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 82.8 m -139.74 175.93 9.16 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.153 2.181 . . . . 0.0 110.809 -162.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.462 ' CD ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -97.17 154.44 38.12 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 126.213 1.805 . . . . 0.0 109.119 158.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.738 ' HA ' HG22 ' A' ' 16' ' ' VAL . 78.1 Cg_exo -47.45 -21.27 1.99 Allowed 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 124.162 3.242 . . . . 0.0 115.371 -170.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.426 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.2 OUTLIER -84.98 7.68 20.4 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.864 2.066 . . . . 0.0 113.028 -162.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 13.1 t -52.35 102.68 0.05 Allowed 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.235 0.925 . . . . 0.0 110.698 -161.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.758 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.17 -44.01 63.7 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.119 1.767 . . . . 0.0 111.112 -166.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.758 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -46.66 153.59 0.37 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.581 1.552 . . . . 0.0 111.168 168.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -46.29 124.04 5.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.556 1.542 . . . . 0.0 110.982 -178.081 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 5.1 m170 -65.36 133.3 51.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.737 1.615 . . . . 0.0 111.48 -168.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -83.97 118.22 23.88 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.348 1.459 . . . . 0.0 110.893 161.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.2 mt -44.97 148.07 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.86 1.664 . . . . 0.0 110.94 -162.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.477 ' CZ ' ' CB ' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -40.0 -37.68 0.62 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.858 1.663 . . . . 0.0 111.107 164.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -71.64 -20.48 61.96 Favored 'General case' 0 C--N 1.351 0.649 0 C-N-CA 125.74 1.616 . . . . 0.0 111.877 -164.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.47 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 45.7 m-20 -103.65 -20.3 14.03 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.943 2.097 . . . . 0.0 111.098 173.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.81 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.65 140.09 16.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 C-N-CA 125.844 1.658 . . . . 0.0 110.14 -173.377 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -138.98 155.63 47.86 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.444 1.498 . . . . 0.0 111.84 169.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.4 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 31.5 m-85 -114.74 136.04 53.5 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.842 1.657 . . . . 0.0 112.553 -160.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.015 ' HB2' HG22 ' A' ' 28' ' ' VAL . 1.4 m-30 -115.11 179.11 4.05 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 128.58 2.752 . . . . 0.0 111.806 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.18 -41.3 64.01 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 125.309 1.443 . . . . 0.0 111.324 162.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.529 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 11.6 p30 -158.56 178.28 10.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.24 1.016 . . . . 0.0 111.706 -171.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.824 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -71.36 -36.57 71.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.777 1.631 . . . . 0.0 111.186 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.637 ' HA ' HD12 ' A' ' 62' ' ' LEU . 4.1 t -61.86 -16.51 50.97 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.231 1.812 . . . . 0.0 111.371 176.5 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.569 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -76.7 -47.41 22.05 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.383 1.473 . . . . 0.0 110.906 168.181 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.785 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.84 -23.27 66.64 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.825 2.05 . . . . 0.0 111.511 171.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 59' ' ' SER . 19.1 mt -66.47 -43.92 84.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.939 2.095 . . . . 0.0 110.206 167.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.569 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.07 -28.39 69.04 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 126.307 1.843 . . . . 0.0 111.542 169.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.32 -15.33 57.14 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.44 1.496 . . . . 0.0 111.597 175.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.56 43.67 11.9 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 125.856 1.694 . . . . 0.0 112.252 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.504 ' HB2' ' HD2' ' A' ' 37' ' ' PHE . 3.6 m-30 -109.62 166.92 10.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.78 1.632 . . . . 0.0 110.907 -175.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 7.5 mmt85 -109.58 150.37 41.13 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 125.784 1.634 . . . . 0.0 111.375 177.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.465 ' HB3' ' HG3' ' A' ' 73' ' ' GLN . 2.8 Cg_exo -76.06 116.29 4.35 Favored 'Trans proline' 0 CA--C 1.545 1.051 1 C-N-CA 125.369 4.046 . . . . 0.0 115.056 -177.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.483 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 29.5 t -49.1 130.13 18.48 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.676 1.99 . . . . 0.0 110.55 -177.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.427 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -70.78 3.22 3.38 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.346 1.458 . . . . 0.0 111.646 -165.114 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.3 -35.13 3.01 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.649 2.379 . . . . 0.0 112.262 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 14.3 m -91.05 -59.78 2.08 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 127.706 2.402 . . . . 0.0 111.405 -168.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG3' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -85.47 -53.18 0.46 Allowed Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.936 1.694 . . . . 0.0 110.975 -160.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.495 ' HG2' ' CE ' ' A' ' 76' ' ' LYS . 4.1 Cg_endo -79.95 -26.66 4.31 Favored 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 125.009 3.806 . . . . 0.0 112.897 168.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.6 t0 65.51 56.57 0.94 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.58 1.552 . . . . 0.0 111.182 -163.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.495 ' CE ' ' HG2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -107.4 40.97 1.58 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.856 1.262 . . . . 0.0 110.434 -163.218 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.459 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -66.67 96.5 0.4 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.508 1.523 . . . . 0.0 111.25 -177.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -52.74 100.83 0.24 Allowed Pre-proline 0 CA--C 1.551 0.981 0 C-N-CA 125.732 1.613 . . . . 0.0 110.97 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.594 ' O ' ' HG2' ' A' ' 81' ' ' GLN . 74.6 Cg_exo -54.08 -62.36 0.32 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 124.331 3.354 . . . . 0.0 112.642 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.642 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 0.0 OUTLIER -22.15 -73.8 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 128.424 2.69 . . . . 0.0 112.708 -174.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 0.4 OUTLIER 40.17 86.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.78 1.632 . . . . 0.0 110.916 -172.082 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -147.37 -172.08 3.94 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.649 1.58 . . . . 0.0 111.382 177.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.7 mtt180 -120.85 94.63 4.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.636 1.575 . . . . 0.0 111.138 170.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 84' ' ' LEU . 0.4 OUTLIER 179.55 53.01 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.518 1.927 . . . . 0.0 112.004 -171.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -68.46 -83.28 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.155 1.782 . . . . 0.0 111.159 176.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 61.89 141.21 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.147 1.779 . . . . 0.0 110.61 -171.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 pt -112.38 -178.64 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 126.14 1.776 . . . . 0.0 108.995 175.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 19.5 p -63.13 170.43 2.85 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.619 1.568 . . . . 0.0 110.013 171.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -43.94 126.08 4.63 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.585 1.554 . . . . 0.0 111.409 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -165.77 154.97 11.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.619 1.567 . . . . 0.0 110.727 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 12.9 t -65.49 -35.16 80.07 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.613 1.565 . . . . 0.0 110.338 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.585 1.554 . . . . 0.0 110.162 172.434 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mtm . . . . . 0 CA--C 1.545 0.756 0 N-CA-C 110.688 -0.116 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 17.9 mttt 50.12 -157.06 0.09 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.625 1.57 . . . . 0.0 110.536 -175.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -110.47 141.1 44.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.625 1.57 . . . . 0.0 110.49 -174.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.743 ' HB1' HD21 ' A' ' 7' ' ' LEU . . . -45.77 153.75 0.26 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.628 1.571 . . . . 0.0 111.277 169.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.9 t -143.37 158.5 43.59 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.561 1.544 . . . . 0.0 110.067 167.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 m 60.45 53.65 4.14 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.592 1.557 . . . . 0.0 110.401 178.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.827 HD13 HH21 ' A' ' 12' ' ' ARG . 0.1 OUTLIER -89.63 19.8 4.41 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.353 1.861 . . . . 0.0 110.933 178.834 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 40.0 p -57.89 133.92 55.87 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.366 1.866 . . . . 0.0 110.816 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.72 -21.68 60.14 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.673 1.589 . . . . 0.0 111.401 -170.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -44.96 -77.31 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.477 1.511 . . . . 0.0 111.171 165.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.788 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.41 -17.89 57.74 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 123.926 0.89 . . . . 0.0 110.495 -169.412 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.827 HH21 HD13 ' A' ' 7' ' ' LEU . 37.0 mmt-85 -43.59 -57.84 2.94 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 122.841 1.305 . . . . 0.0 109.83 159.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.65 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 32.8 t-105 -69.3 -20.8 63.89 Favored 'General case' 0 C--N 1.363 1.165 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.775 175.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.788 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 1.3 tt0 -61.68 -59.68 4.81 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 118.442 0.565 . . . . 0.0 110.449 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -28.93 59.57 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.947 1.299 . . . . 0.0 112.509 176.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.65 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 2.6 t -89.72 -30.63 5.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 126.353 1.861 . . . . 0.0 110.337 -175.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mt -73.09 -39.02 66.18 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.691 1.597 . . . . 0.0 110.893 171.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.39 -21.19 14.48 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.654 1.582 . . . . 0.0 110.254 171.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 79.5 32.78 0.23 Allowed 'General case' 0 C--N 1.353 0.747 0 C-N-CA 125.89 1.676 . . . . 0.0 111.085 175.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -61.11 120.38 53.93 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.84 1.256 . . . . 0.0 110.428 -163.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -78.91 -54.12 0.05 OUTLIER 'Trans proline' 0 CA--C 1.554 1.505 0 C-N-CA 125.064 3.843 . . . . 0.0 112.232 178.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.9 t30 -80.14 12.75 2.65 Favored 'General case' 0 C--N 1.366 1.302 0 C-N-CA 126.888 2.075 . . . . 0.0 111.048 -167.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -93.14 20.73 6.55 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.937 1.695 . . . . 0.0 110.469 160.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' CB ' ' HD2' ' A' ' 39' ' ' ARG . 23.4 p-10 -55.3 -15.46 2.5 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.388 1.875 . . . . 0.0 112.938 168.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -118.82 -13.2 6.74 Favored Glycine 0 CA--C 1.543 1.842 0 C-N-CA 126.04 1.781 . . . . 0.0 112.089 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -72.81 -50.17 25.89 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.855 1.662 . . . . 0.0 110.655 -178.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.861 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -168.11 179.8 4.43 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.708 1.203 . . . . 0.0 112.263 -173.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.996 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.3 m -126.17 173.79 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 127.082 2.153 . . . . 0.0 109.208 160.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.507 ' HD1' HG22 ' A' ' 52' ' ' VAL . 39.6 p90 -141.96 158.71 43.46 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.062 0.945 . . . . 0.0 111.864 167.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.053 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -135.73 117.7 15.29 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.7 2.0 . . . . 0.0 111.249 -162.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.944 ' CG1' HG22 ' A' ' 33' ' ' THR . 34.1 t -94.35 100.69 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 125.377 1.471 . . . . 0.0 110.167 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.23 -26.79 5.06 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.629 1.572 . . . . 0.0 111.244 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.944 HG22 ' CG1' ' A' ' 31' ' ' VAL . 5.1 t -82.32 -36.02 27.36 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.673 1.589 . . . . 0.0 110.815 -165.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.66 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.0 t -100.3 -17.93 17.06 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.696 1.598 . . . . 0.0 110.998 -173.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.82 45.15 90.17 Favored Glycine 0 CA--C 1.543 1.798 0 C-N-CA 125.446 1.498 . . . . 0.0 111.637 -171.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' HB ' HG23 ' A' ' 34' ' ' THR . 73.4 mt -125.6 158.39 34.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 C-N-CA 126.119 1.768 . . . . 0.0 110.039 -178.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.864 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 17.1 p90 -133.82 141.92 47.64 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.662 1.585 . . . . 0.0 110.906 162.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 70.8 m -119.51 171.25 8.48 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.12 2.168 . . . . 0.0 111.837 -173.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.671 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 14.5 ttp180 -85.49 153.79 58.93 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.788 2.035 . . . . 0.0 109.162 157.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.861 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 10.1 Cg_endo -44.47 -21.82 0.5 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.528 3.485 . . . . 0.0 115.816 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.16 23.29 2.91 Favored 'General case' 0 C--O 1.244 0.784 0 C-N-CA 126.008 1.723 . . . . 0.0 112.26 -160.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.9 t -69.54 104.4 2.33 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 119.921 1.237 . . . . 0.0 110.53 -161.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.517 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -72.65 -50.78 22.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.942 1.697 . . . . 0.0 111.228 -163.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.517 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.81 152.01 0.8 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.427 1.491 . . . . 0.0 111.138 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.1 ptm85 -48.31 107.61 0.14 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.216 1.406 . . . . 0.0 110.786 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 13.1 m170 -49.77 157.4 0.58 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.216 1.807 . . . . 0.0 111.989 -162.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -104.33 128.26 52.11 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.874 1.67 . . . . 0.0 110.844 161.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.1 mt -47.08 149.75 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.573 1.549 . . . . 0.0 111.351 -161.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.488 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.76 -31.91 2.26 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.741 2.016 . . . . 0.0 111.514 170.474 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -75.91 -18.84 59.22 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 125.957 1.703 . . . . 0.0 112.104 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -101.86 -10.74 19.6 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.178 1.791 . . . . 0.0 111.35 175.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.635 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.5 OUTLIER -110.82 143.23 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.071 1.748 . . . . 0.0 110.176 -168.578 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.2 p -138.61 158.32 44.47 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.942 1.697 . . . . 0.0 111.857 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.501 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 64.1 m-85 -115.61 133.71 55.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.639 1.576 . . . . 0.0 112.257 -161.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.053 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 33.1 m-85 -111.07 179.75 3.96 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.904 2.882 . . . . 0.0 112.138 173.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.35 -40.84 29.24 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 126.228 1.811 . . . . 0.0 111.44 165.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.53 ' HA ' HG13 ' A' ' 28' ' ' VAL . 9.7 p30 -158.68 177.98 10.61 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.228 1.411 . . . . 0.0 111.588 -174.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.864 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -84.23 -8.47 59.04 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.006 1.723 . . . . 0.0 111.597 -170.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.466 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 4.1 t -72.62 -38.83 67.64 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.896 1.678 . . . . 0.0 111.878 166.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.561 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.5 OUTLIER -63.54 -40.57 97.36 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.061 1.744 . . . . 0.0 109.952 167.521 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.684 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -70.14 -34.3 72.88 Favored 'General case' 0 C--N 1.355 0.835 0 C-N-CA 125.814 1.646 . . . . 0.0 111.013 176.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -65.92 -39.47 90.58 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 126.337 1.855 . . . . 0.0 110.47 165.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.9 -26.05 67.17 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.239 1.816 . . . . 0.0 111.368 176.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.41 -16.94 53.25 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.493 1.517 . . . . 0.0 111.645 171.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.4 45.35 24.35 Favored Glycine 0 CA--C 1.543 1.831 0 C-N-CA 125.768 1.651 . . . . 0.0 112.048 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.883 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 7.6 m-30 -105.81 167.37 9.83 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.587 1.555 . . . . 0.0 110.947 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.441 ' HG2' ' HD2' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -115.68 136.92 22.91 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.709 1.604 . . . . 0.0 111.342 -170.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 55.8 Cg_endo -63.5 113.39 2.08 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.854 3.702 . . . . 0.0 115.214 -173.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.467 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 40.0 t -48.52 141.23 7.11 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.471 1.909 . . . . 0.0 110.849 175.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -70.42 -5.0 25.26 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.856 1.662 . . . . 0.0 111.391 -164.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.441 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -125.65 -43.41 1.88 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.938 2.095 . . . . 0.0 111.168 -166.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 2.3 m -102.0 -47.98 4.39 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.435 1.894 . . . . 0.0 111.231 -162.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.613 ' CD ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.34 147.11 95.03 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.378 1.471 . . . . 0.0 110.303 162.152 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -35.31 92.18 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.861 3.707 . . . . 0.0 113.337 170.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 -66.35 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.602 1.561 . . . . 0.0 111.198 -174.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -130.78 55.34 1.84 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.117 1.367 . . . . 0.0 110.276 164.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.25 134.83 34.05 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.572 1.549 . . . . 0.0 111.257 164.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 55.72 69.82 1.77 Allowed Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 125.639 1.575 . . . . 0.0 111.049 176.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.409 ' HG2' ' H ' ' A' ' 80' ' ' ARG . 68.2 Cg_endo -68.79 -87.65 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.175 0 C-N-CA 124.326 3.35 . . . . 0.0 112.665 -170.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' H ' ' HG2' ' A' ' 79' ' ' PRO . 7.0 ttp180 -21.08 -67.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 128.39 2.676 . . . . 0.0 112.982 -173.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -16.33 109.93 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 128.091 2.556 . . . . 0.0 112.369 171.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.45 ' CD2' ' N ' ' A' ' 82' ' ' HIS . 2.2 m-70 -94.82 -54.64 3.4 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.366 1.467 . . . . 0.0 111.341 -164.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.404 ' O ' HD22 ' A' ' 84' ' ' LEU . 8.3 mtm180 47.15 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.165 1.386 . . . . 0.0 110.775 -162.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.408 ' HA ' HD13 ' A' ' 84' ' ' LEU . 0.1 OUTLIER 179.47 152.65 0.41 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.485 1.914 . . . . 0.0 111.99 -167.642 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -62.51 -75.44 0.07 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.109 1.764 . . . . 0.0 111.208 177.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 168.25 161.92 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.261 1.825 . . . . 0.0 110.54 -171.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.1 mt -84.62 88.94 2.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 125.704 1.602 . . . . 0.0 109.024 -166.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.41 HG22 ' N ' ' A' ' 89' ' ' HIS . 21.6 m -52.93 -87.71 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.593 1.557 . . . . 0.0 110.076 -179.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.41 ' N ' HG22 ' A' ' 88' ' ' THR . 3.9 p-80 -100.37 -6.53 25.62 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.684 1.593 . . . . 0.0 111.826 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 65.64 -164.51 0.24 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.306 1.442 . . . . 0.0 110.686 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 3.0 p -99.37 178.57 4.85 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.575 1.55 . . . . 0.0 110.367 177.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.534 0 C-N-CA 125.581 1.552 . . . . 0.0 110.12 -173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ttt . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 110.732 -0.099 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -124.75 -84.8 0.64 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.569 1.548 . . . . 0.0 110.532 174.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 10.1 mttt -86.98 97.79 10.9 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.606 1.562 . . . . 0.0 110.508 -170.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 164.94 -46.07 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.595 1.558 . . . . 0.0 111.247 -170.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 m -128.78 87.42 2.57 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.61 1.564 . . . . 0.0 110.068 -179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.723 ' HB3' HG23 ' A' ' 8' ' ' THR . 0.1 OUTLIER -179.43 161.39 1.06 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.607 1.563 . . . . 0.0 110.374 -171.639 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -89.68 21.58 3.43 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.381 1.872 . . . . 0.0 110.901 -173.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.723 HG23 ' HB3' ' A' ' 6' ' ' CYS . 30.2 p -48.52 146.4 2.99 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.23 1.812 . . . . 0.0 110.787 178.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.54 ' HB2' ' NH2' ' A' ' 49' ' ' ARG . 1.2 p30 -63.55 -27.35 69.2 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.653 1.581 . . . . 0.0 111.401 -170.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -40.61 -74.81 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 111.123 163.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.667 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 2.6 tt0 -74.92 -24.21 58.47 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.402 1.081 . . . . 0.0 110.816 -168.003 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -40.2 -57.77 1.63 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.182 1.393 . . . . 0.0 110.599 160.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.896 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 37.5 t-105 -76.11 -13.71 60.2 Favored 'General case' 0 C--N 1.361 1.068 0 CA-C-N 115.111 -0.949 . . . . 0.0 112.169 175.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.667 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER -69.31 -56.04 8.68 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.961 0.8 . . . . 0.0 110.493 169.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -39.67 -49.87 2.26 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 111.841 164.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.782 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 19.1 t -84.77 -24.79 7.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 125.272 1.429 . . . . 0.0 111.152 -170.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.494 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 10.6 mt -76.43 -42.96 42.21 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.866 1.267 . . . . 0.0 110.682 170.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.28 -18.07 34.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.873 1.669 . . . . 0.0 110.644 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER 75.29 18.49 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.541 1.936 . . . . 0.0 110.94 176.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -64.22 96.93 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 C-N-CA 126.128 1.771 . . . . 0.0 110.887 -168.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -63.98 -13.7 38.95 Favored 'Trans proline' 0 CA--C 1.547 1.152 0 C-N-CA 124.354 3.369 . . . . 0.0 112.843 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -83.47 -0.94 52.33 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.615 1.966 . . . . 0.0 111.607 -163.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.906 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -95.57 18.06 13.57 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.326 1.45 . . . . 0.0 110.915 173.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.474 ' HA ' ' CD ' ' A' ' 39' ' ' ARG . 23.7 t0 -46.25 112.59 0.51 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.445 1.498 . . . . 0.0 111.051 160.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.39 -18.73 39.99 Favored Glycine 0 CA--C 1.543 1.81 0 C-N-CA 125.542 1.544 . . . . 0.0 112.165 177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.32 -31.96 71.74 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.751 1.62 . . . . 0.0 110.519 171.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.79 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -173.58 -178.34 1.62 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.851 1.261 . . . . 0.0 111.933 169.124 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.073 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.6 m -123.35 172.66 10.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.723 2.009 . . . . 0.0 109.313 160.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 38' ' ' CYS . 13.9 p90 -134.95 151.23 50.67 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.701 1.2 . . . . 0.0 111.327 166.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.767 ' HB2' ' CE1' ' A' ' 55' ' ' TYR . . . -134.08 113.25 11.89 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.439 1.896 . . . . 0.0 111.289 -163.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.949 HG12 HG22 ' A' ' 33' ' ' THR . 95.5 t -93.92 95.73 5.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 124.868 1.267 . . . . 0.0 109.906 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -53.05 -21.36 4.52 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.712 1.605 . . . . 0.0 111.229 -168.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.949 HG22 HG12 ' A' ' 31' ' ' VAL . 6.6 t -76.79 -37.71 55.32 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.799 1.64 . . . . 0.0 110.867 -170.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 ' H ' ' A' ' 36' ' ' ILE . 6.5 t -100.11 -5.08 28.42 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.617 1.567 . . . . 0.0 111.275 170.664 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.71 34.62 3.89 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 126.058 1.789 . . . . 0.0 108.888 -176.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.579 ' H ' HG23 ' A' ' 34' ' ' THR . 40.0 mt -97.46 161.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.363 1.176 0 C-N-CA 125.787 1.635 . . . . 0.0 109.983 167.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.786 ' CD2' ' HB3' ' A' ' 61' ' ' ALA . 0.0 OUTLIER -136.47 148.39 47.67 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.328 1.451 . . . . 0.0 111.427 172.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 56.3 m -129.12 178.59 6.3 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 127.569 2.348 . . . . 0.0 111.706 -175.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.886 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.1 OUTLIER -92.13 155.15 43.12 Favored Pre-proline 0 CA--C 1.553 1.094 0 C-N-CA 126.663 1.985 . . . . 0.0 108.961 156.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.906 ' HG3' ' HB3' ' A' ' 23' ' ' ALA . 13.6 Cg_endo -49.5 -21.29 4.93 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.462 3.441 . . . . 0.0 115.345 -165.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.73 8.63 13.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.529 1.932 . . . . 0.0 112.625 -160.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 8.0 t -52.57 110.9 0.56 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.988 0.915 . . . . 0.0 110.733 -161.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -68.11 -38.61 82.46 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.954 1.701 . . . . 0.0 111.074 -166.569 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' ARG . . . -47.53 140.49 5.92 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.558 1.543 . . . . 0.0 111.178 171.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -45.05 95.94 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.463 1.505 . . . . 0.0 110.99 169.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.469 ' ND1' HD23 ' A' ' 17' ' ' LEU . 3.6 m170 -47.63 149.05 1.28 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.328 1.451 . . . . 0.0 111.285 -164.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -82.18 129.62 34.88 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.386 1.474 . . . . 0.0 110.669 160.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 5.8 mt -47.98 152.56 0.77 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.464 1.506 . . . . 0.0 110.854 -162.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.54 ' NH2' ' HB2' ' A' ' 9' ' ' ASP . 32.9 tpt85 -46.86 -27.45 1.24 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.292 1.837 . . . . 0.0 111.456 166.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -66.14 -25.77 67.13 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.941 1.696 . . . . 0.0 111.73 -171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 65.4 m-80 -109.92 -10.17 14.75 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.879 2.072 . . . . 0.0 111.456 175.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.92 HG23 HG22 ' A' ' 31' ' ' VAL . 1.1 t -101.08 132.44 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 126.367 1.867 . . . . 0.0 110.365 -169.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -139.95 157.98 44.81 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.479 1.512 . . . . 0.0 112.222 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.489 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.6 OUTLIER -114.29 139.57 49.31 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 125.81 1.644 . . . . 0.0 112.631 -161.149 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.073 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.8 m-85 -116.11 179.72 3.91 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 128.979 2.912 . . . . 0.0 111.882 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.61 -39.73 36.45 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.367 1.467 . . . . 0.0 111.807 166.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.585 ' HA ' HG13 ' A' ' 28' ' ' VAL . 46.0 p30 -162.19 -177.81 5.96 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.576 1.15 . . . . 0.0 111.723 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.774 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -64.78 -22.34 66.96 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.328 1.851 . . . . 0.0 111.636 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 2.0 m -73.88 -35.77 64.74 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.382 1.473 . . . . 0.0 112.225 -177.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.675 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.1 tp10 -64.29 -43.81 93.62 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.416 1.486 . . . . 0.0 109.785 170.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.786 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . . . -74.47 -25.09 59.17 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.593 1.157 . . . . 0.0 111.223 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.3 mt -70.11 -38.78 75.69 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.3 1.44 . . . . 0.0 110.656 163.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.675 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.25 -21.91 60.32 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.509 1.523 . . . . 0.0 111.155 165.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.76 -13.12 54.67 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.283 1.433 . . . . 0.0 111.741 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 101.4 -9.86 57.66 Favored Glycine 0 CA--C 1.551 2.292 0 C-N-CA 124.176 0.894 . . . . 0.0 113.64 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.412 ' N ' ' HD1' ' A' ' 66' ' ' PHE . 1.6 m-30 -79.66 168.19 19.68 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.265 1.826 . . . . 0.0 111.789 -160.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.426 ' C ' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -116.22 154.15 48.66 Favored Pre-proline 0 CA--C 1.551 1.0 0 C-N-CA 126.781 2.033 . . . . 0.0 111.41 -179.09 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.561 ' N ' ' HE1' ' A' ' 37' ' ' PHE . 1.0 OUTLIER -82.73 115.05 2.4 Favored 'Trans proline' 0 CA--C 1.547 1.17 1 C-N-CA 125.473 4.116 . . . . 0.0 115.111 -170.983 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.437 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 21.2 t -43.17 149.14 0.24 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.902 2.081 . . . . 0.0 110.803 -176.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt -79.65 7.21 8.82 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.274 1.43 . . . . 0.0 111.044 -168.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.768 ' HD3' ' HD3' ' A' ' 43' ' ' ARG . 7.4 ttm-85 -130.44 -45.23 1.1 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.99 1.716 . . . . 0.0 110.924 -168.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 7.9 m -98.98 -67.88 0.83 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.883 1.673 . . . . 0.0 111.343 -169.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.496 ' HB3' ' CB ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -60.13 -52.23 74.83 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.885 1.274 . . . . 0.0 110.476 -162.193 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.477 ' CG ' ' HG3' ' A' ' 76' ' ' LYS . 62.2 Cg_endo -89.27 -26.25 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.971 0 C-N-CA 125.071 3.847 . . . . 0.0 113.415 174.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.1 t70 72.52 59.43 0.13 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.865 1.666 . . . . 0.0 111.241 -164.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.477 ' HG3' ' CG ' ' A' ' 74' ' ' PRO . 2.8 mtmt -103.32 45.57 0.95 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.148 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.23 130.48 35.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.601 1.56 . . . . 0.0 111.338 170.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -59.43 106.94 0.82 Allowed Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 125.608 1.563 . . . . 0.0 111.017 -174.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.12 -11.21 25.09 Favored 'Trans proline' 0 CA--C 1.548 1.177 0 C-N-CA 124.426 3.417 . . . . 0.0 113.095 -169.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -16.99 -88.31 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 128.298 2.639 . . . . 0.0 113.242 -163.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -15.47 109.21 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 128.458 2.703 . . . . 0.0 112.614 177.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.9 m80 56.86 118.05 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.729 1.611 . . . . 0.0 111.401 -163.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ttp85 -100.51 58.19 0.94 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.62 1.168 . . . . 0.0 110.467 161.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.811 HD22 ' H ' ' A' ' 85' ' ' ASP . 2.9 tm? -37.28 142.01 0.13 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.063 2.145 . . . . 0.0 111.366 -177.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.811 ' H ' HD22 ' A' ' 84' ' ' LEU . 10.4 t70 -45.35 -71.97 0.07 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.497 1.519 . . . . 0.0 111.2 -170.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.537 ' HB3' HD12 ' A' ' 87' ' ' ILE . 0.5 OUTLIER 166.18 -168.6 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.459 1.904 . . . . 0.0 110.682 168.682 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.537 HD12 ' HB3' ' A' ' 86' ' ' LYS . 1.7 mp 72.48 153.44 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.884 1.674 . . . . 0.0 109.001 165.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.2 m -78.97 -59.02 2.95 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.616 1.566 . . . . 0.0 110.099 175.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 24.3 t60 55.03 95.41 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.585 1.554 . . . . 0.0 111.387 -173.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.22 -72.24 0.26 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.599 1.56 . . . . 0.0 110.726 176.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.7 p -165.41 141.38 5.33 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.595 1.558 . . . . 0.0 110.377 -178.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.619 1.568 . . . . 0.0 110.167 -174.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.727 -0.101 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.4 -153.57 0.27 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.673 1.589 . . . . 0.0 110.526 -166.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER 83.41 124.4 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.581 1.552 . . . . 0.0 110.525 172.441 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.21 -19.12 0.43 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 111.495 175.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.83 -27.04 12.45 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.522 1.529 . . . . 0.0 110.063 -168.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.5 m 45.85 54.86 7.5 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.563 1.545 . . . . 0.0 110.361 -174.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.403 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.3 OUTLIER -89.66 19.65 4.52 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.427 1.891 . . . . 0.0 110.926 -169.319 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 81.6 p -51.74 124.77 13.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.835 1.654 . . . . 0.0 110.775 -175.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -72.72 -22.09 60.94 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.518 1.527 . . . . 0.0 111.309 -165.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -44.25 -76.86 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.389 1.476 . . . . 0.0 111.082 166.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.969 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.8 OUTLIER -76.25 -21.86 55.83 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.12 0.968 . . . . 0.0 110.77 -169.188 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.1 mmp_? -42.26 -57.42 2.56 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-O 122.669 1.223 . . . . 0.0 110.204 160.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.523 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 44.9 t-105 -70.69 -18.08 62.83 Favored 'General case' 0 C--N 1.362 1.144 0 CA-C-N 114.348 -1.297 . . . . 0.0 111.595 175.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.969 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -64.62 -56.58 12.93 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.156 0.582 . . . . 0.0 110.629 168.126 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.3 m -49.76 -38.02 32.16 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.738 1.215 . . . . 0.0 112.577 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.543 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.6 t -89.88 -25.88 5.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 110.386 -170.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.479 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.8 mt -75.31 -37.13 60.97 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.328 1.451 . . . . 0.0 110.662 167.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.84 -16.34 27.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.966 1.706 . . . . 0.0 110.569 162.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 57.01 36.02 27.2 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.94 1.696 . . . . 0.0 110.331 169.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -61.51 103.29 0.37 Allowed Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 125.911 1.684 . . . . 0.0 110.602 -162.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.459 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.3 Cg_exo -44.66 -62.43 0.44 Allowed 'Trans proline' 0 CA--C 1.548 1.224 0 C-N-CA 124.371 3.381 . . . . 0.0 114.641 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -86.77 19.81 2.8 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.602 1.961 . . . . 0.0 110.705 -169.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.518 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -79.61 -1.88 40.06 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.944 1.698 . . . . 0.0 111.198 163.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.477 ' HB3' ' HG3' ' A' ' 39' ' ' ARG . 3.6 p30 -50.23 131.83 23.9 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.111 1.364 . . . . 0.0 111.016 161.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.45 -23.87 6.95 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 125.434 1.492 . . . . 0.0 112.256 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -72.66 -42.42 64.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.538 1.535 . . . . 0.0 110.501 175.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.771 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 16.8 p90 -160.05 -179.13 7.51 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.675 1.19 . . . . 0.0 111.97 167.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.987 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -124.76 174.62 8.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 126.655 1.982 . . . . 0.0 109.284 160.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.605 ' HE1' ' O ' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -145.51 158.91 43.77 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.992 0.917 . . . . 0.0 112.109 165.064 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.623 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.81 112.42 11.93 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 126.756 2.022 . . . . 0.0 111.358 -161.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.838 HG22 HG23 ' A' ' 52' ' ' VAL . 67.3 t -93.34 95.34 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.034 1.334 . . . . 0.0 109.959 -179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -53.97 -26.67 26.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.915 1.686 . . . . 0.0 111.473 -164.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.57 HG22 HG12 ' A' ' 31' ' ' VAL . 14.8 t -82.12 -27.15 32.96 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.444 1.497 . . . . 0.0 110.98 -163.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.891 HG23 HG13 ' A' ' 36' ' ' ILE . 0.6 OUTLIER -100.54 -20.85 15.53 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.566 1.546 . . . . 0.0 110.902 170.061 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.35 96.77 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.539 1.542 . . . . 0.0 111.76 -175.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.891 HG13 HG23 ' A' ' 34' ' ' THR . 38.5 mt -106.04 160.71 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 125.678 1.591 . . . . 0.0 109.917 165.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.895 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 8.7 p90 -126.82 152.0 47.55 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.588 1.555 . . . . 0.0 110.957 165.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.531 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 70.0 m -133.19 176.04 8.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.724 2.41 . . . . 0.0 110.612 -165.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.992 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -98.85 149.17 35.49 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.037 2.135 . . . . 0.0 109.71 160.281 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.992 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 6.7 Cg_endo -40.61 -26.25 0.22 Allowed 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 124.917 3.744 . . . . 0.0 115.567 -175.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 22.7 t -86.37 19.62 2.7 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.911 2.084 . . . . 0.0 112.502 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -64.42 92.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.119 -0.988 . . . . 0.0 110.355 -161.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.954 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 6.0 ptt180 -63.14 -49.77 73.05 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.026 1.73 . . . . 0.0 111.374 -161.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.441 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -54.97 128.41 33.34 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.366 1.467 . . . . 0.0 111.059 173.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.71 93.49 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.01 1.724 . . . . 0.0 111.033 -167.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.02 140.37 33.97 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.345 1.458 . . . . 0.0 111.533 -162.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -53.24 155.86 2.53 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.022 1.729 . . . . 0.0 111.335 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.2 mt -62.88 153.82 32.07 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.882 1.673 . . . . 0.0 110.869 -165.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.503 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -43.29 -34.08 1.12 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.934 1.694 . . . . 0.0 111.205 167.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -72.16 -17.35 61.95 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 125.704 1.602 . . . . 0.0 111.951 -163.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -109.59 -16.27 13.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.452 1.901 . . . . 0.0 111.14 173.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.838 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -87.96 141.38 14.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 125.889 1.676 . . . . 0.0 110.332 -176.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 p -139.96 156.74 46.51 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.662 1.585 . . . . 0.0 111.78 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 45.7 m-85 -114.83 131.39 56.84 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.627 1.571 . . . . 0.0 112.081 -161.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.987 ' HB2' HG22 ' A' ' 28' ' ' VAL . 13.3 m-85 -107.8 179.85 4.11 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 128.894 2.878 . . . . 0.0 111.762 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.03 -41.99 49.22 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 125.813 1.645 . . . . 0.0 111.588 164.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.694 ' HA ' HG13 ' A' ' 28' ' ' VAL . 19.3 p30 -155.4 175.69 13.54 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.17 1.388 . . . . 0.0 111.429 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.895 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -66.23 -31.55 72.45 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.677 1.591 . . . . 0.0 111.208 -172.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.505 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.3 OUTLIER -63.71 -29.47 70.69 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.545 1.538 . . . . 0.0 111.313 -178.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.509 ' HG3' ' CD1' ' A' ' 55' ' ' TYR . 40.3 tp10 -66.25 -44.18 84.44 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.097 1.759 . . . . 0.0 110.07 169.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.702 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -66.79 -29.84 69.89 Favored 'General case' 0 C--N 1.356 0.866 0 C-N-CA 124.928 1.291 . . . . 0.0 110.871 174.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.505 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 0.5 OUTLIER -69.0 -40.18 78.9 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.49 2.716 . . . . 0.0 110.502 170.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.57 -25.64 68.17 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.307 1.843 . . . . 0.0 111.247 171.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -84.2 -12.61 54.56 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.872 1.669 . . . . 0.0 111.787 172.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.559 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 81.61 46.7 6.69 Favored Glycine 0 CA--C 1.543 1.809 0 C-N-CA 125.612 1.577 . . . . 0.0 112.192 177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.623 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.9 m-30 -114.61 152.63 31.53 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.609 1.564 . . . . 0.0 110.935 -177.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 36' ' ' ILE . 2.3 mtp85 -102.0 154.19 37.51 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.86 1.664 . . . . 0.0 111.369 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.467 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 72.5 Cg_endo -81.85 113.75 2.53 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.459 3.439 . . . . 0.0 115.44 -169.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.433 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 12.7 t -42.69 147.11 0.31 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.304 2.242 . . . . 0.0 111.062 -173.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 0.3 OUTLIER -82.21 15.86 2.23 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.822 1.649 . . . . 0.0 110.942 -170.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.954 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 0.5 OUTLIER -135.25 -50.26 0.74 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.394 1.877 . . . . 0.0 111.073 -177.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.4 m -88.85 -74.87 0.45 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.252 1.421 . . . . 0.0 111.063 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.669 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -87.56 162.03 43.49 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 125.125 1.37 . . . . 0.0 110.507 -160.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -39.63 90.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.06 1 C-N-CA 125.438 4.092 . . . . 0.0 113.954 -163.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.7 t0 -169.21 -72.12 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.518 1.527 . . . . 0.0 111.228 -174.052 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.74 124.82 30.6 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.991 1.316 . . . . 0.0 110.266 167.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -50.92 140.06 16.04 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.729 1.612 . . . . 0.0 111.267 -171.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.92 163.72 20.42 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 125.506 1.523 . . . . 0.0 110.922 -175.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -45.67 149.92 1.74 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.268 3.312 . . . . 0.0 112.465 173.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.531 ' O ' ' HG3' ' A' ' 81' ' ' GLN . 2.0 ttt-85 24.64 -105.51 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.946 2.099 . . . . 0.0 112.05 -168.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 80' ' ' ARG . 4.4 mt-30 160.39 151.21 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 127.845 2.458 . . . . 0.0 111.802 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -107.62 -25.58 11.27 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.792 1.637 . . . . 0.0 111.473 -175.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 32.25 55.51 0.35 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.39 1.476 . . . . 0.0 110.5 -161.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.808 HD22 ' N ' ' A' ' 85' ' ' ASP . 1.3 tm? -33.86 129.2 0.34 Allowed 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.395 2.278 . . . . 0.0 112.254 -162.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.808 ' N ' HD22 ' A' ' 84' ' ' LEU . 4.1 p-10 -63.37 -142.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.391 1.876 . . . . 0.0 111.305 175.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 169.03 -39.2 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.297 1.839 . . . . 0.0 110.513 165.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 41.52 79.63 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 C-N-CA 126.189 1.796 . . . . 0.0 109.026 -178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.8 t -63.99 140.95 58.92 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.562 1.545 . . . . 0.0 110.025 -166.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -146.41 127.35 14.52 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.618 1.567 . . . . 0.0 111.452 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -69.98 157.87 36.68 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.576 1.55 . . . . 0.0 110.755 -176.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.22 156.02 36.22 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.634 1.574 . . . . 0.0 110.375 -176.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.53 0 C-N-CA 125.595 1.558 . . . . 0.0 110.123 -171.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 110.715 -0.106 . . . . 0.0 110.715 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -111.88 29.81 7.55 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.612 1.565 . . . . 0.0 110.502 -170.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 1.1 ttpt -172.21 -147.72 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.596 1.558 . . . . 0.0 110.518 -173.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 82.12 -89.91 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.607 1.563 . . . . 0.0 111.251 173.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 41.21 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.584 1.554 . . . . 0.0 110.062 -173.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.36 87.04 4.03 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.542 1.537 . . . . 0.0 110.35 -176.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.562 HD13 ' NH1' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.64 17.9 6.0 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.433 1.893 . . . . 0.0 110.918 173.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.1 p -48.03 125.96 9.92 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.167 1.787 . . . . 0.0 110.767 -171.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -60.82 -34.92 75.28 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.838 1.655 . . . . 0.0 111.436 -170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -36.11 -69.23 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.437 1.495 . . . . 0.0 111.056 171.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.955 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -86.15 -20.25 28.91 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.651 1.18 . . . . 0.0 111.125 -168.334 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.562 ' NH1' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -45.61 -54.53 7.54 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 123.535 1.636 . . . . 0.0 109.354 159.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.85 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 19.1 t-105 -79.27 -17.35 54.87 Favored 'General case' 0 C--N 1.362 1.133 0 CA-C-N 114.061 -1.427 . . . . 0.0 112.348 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.955 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 17.1 mm-40 -74.64 -44.4 50.67 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 119.233 0.924 . . . . 0.0 110.412 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.2 m -50.56 -47.43 57.85 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 125.525 1.53 . . . . 0.0 112.222 163.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.732 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.0 t -87.44 -25.47 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.768 0 C-N-CA 125.888 1.675 . . . . 0.0 110.967 -167.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.1 mt -74.49 -43.45 55.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.072 1.349 . . . . 0.0 110.577 169.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.81 -10.11 25.6 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.251 1.82 . . . . 0.0 110.928 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.4 ptt85 49.23 25.51 1.24 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.63 1.572 . . . . 0.0 110.239 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -55.41 97.38 0.12 Allowed Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.349 1.86 . . . . 0.0 110.796 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -62.3 -13.21 31.12 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.164 3.243 . . . . 0.0 112.945 -168.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -84.51 -3.53 58.45 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.722 2.009 . . . . 0.0 111.635 -166.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.573 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -87.92 10.16 19.71 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.652 1.581 . . . . 0.0 111.064 169.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -50.42 127.17 16.89 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.302 1.441 . . . . 0.0 111.046 161.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 84.8 -18.78 24.27 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 125.494 1.521 . . . . 0.0 112.134 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -74.22 -51.0 16.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.91 1.684 . . . . 0.0 110.356 -177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.845 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 13.0 p90 -150.38 -177.42 5.94 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.733 1.213 . . . . 0.0 112.039 177.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.002 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.5 m -129.54 172.59 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 126.222 1.809 . . . . 0.0 109.219 160.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.592 ' HD1' HG22 ' A' ' 52' ' ' VAL . 17.5 p90 -139.2 154.45 48.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.206 1.002 . . . . 0.0 111.156 166.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -133.32 114.78 14.14 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.45 1.9 . . . . 0.0 111.155 -161.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.958 HG22 HG23 ' A' ' 52' ' ' VAL . 21.8 t -93.21 105.81 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 124.976 1.31 . . . . 0.0 109.941 177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.58 -20.02 64.29 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.614 1.566 . . . . 0.0 111.225 -171.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.635 HG22 HG12 ' A' ' 31' ' ' VAL . 8.8 t -96.49 -18.35 19.9 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.622 1.569 . . . . 0.0 110.866 -164.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.577 HG23 ' N ' ' A' ' 36' ' ' ILE . 9.0 t -100.44 -27.88 13.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.638 1.575 . . . . 0.0 110.842 170.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.71 51.3 56.88 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.263 1.411 . . . . 0.0 111.422 -162.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.577 ' N ' HG23 ' A' ' 34' ' ' THR . 39.8 mt -123.1 160.97 25.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 126.16 1.784 . . . . 0.0 109.904 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.905 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 11.0 p90 -138.17 154.06 49.17 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.185 1.394 . . . . 0.0 111.118 165.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 62.6 m -135.84 168.43 19.33 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.941 2.096 . . . . 0.0 111.389 -165.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.87 154.22 55.35 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.031 1.732 . . . . 0.0 109.098 158.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.845 ' HB3' ' CE1' ' A' ' 27' ' ' PHE . 2.2 Cg_endo -42.48 -25.77 0.51 Allowed 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 124.647 3.565 . . . . 0.0 115.38 -173.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.48 25.05 2.39 Favored 'General case' 0 C--O 1.245 0.839 0 C-N-CA 126.021 1.729 . . . . 0.0 112.331 -161.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.8 t -62.79 93.64 0.06 Allowed 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.823 1.192 . . . . 0.0 110.338 -165.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.846 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -71.5 -48.04 51.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.669 1.588 . . . . 0.0 111.127 -163.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.846 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -56.41 134.15 53.56 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.492 1.517 . . . . 0.0 111.294 171.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -44.67 122.2 3.04 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.044 1.738 . . . . 0.0 111.201 -168.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.99 144.91 30.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.442 1.497 . . . . 0.0 111.393 -170.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 146.74 51.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.527 1.531 . . . . 0.0 111.198 164.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 7.7 mt -58.14 165.08 2.06 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.479 1.511 . . . . 0.0 110.774 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -33.12 1.43 Allowed 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.653 1.581 . . . . 0.0 110.936 166.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -60.73 -18.84 56.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 125.234 1.414 . . . . 0.0 111.641 -168.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -121.8 -15.23 7.94 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.291 1.836 . . . . 0.0 111.389 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.958 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -95.06 138.57 20.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 126.0 1.72 . . . . 0.0 110.359 -179.524 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -139.85 156.65 46.61 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.316 1.447 . . . . 0.0 111.927 174.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 52.8 m-85 -111.08 134.66 52.51 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.615 1.566 . . . . 0.0 112.233 -161.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.002 ' HB2' HG22 ' A' ' 28' ' ' VAL . 23.8 m-85 -113.93 -178.85 3.47 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 128.898 2.879 . . . . 0.0 112.234 172.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.1 -41.16 43.25 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 126.286 1.834 . . . . 0.0 111.496 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.732 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 12.4 p30 -160.0 178.23 9.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.227 1.411 . . . . 0.0 111.489 -173.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.905 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -78.41 -14.24 59.48 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.499 1.52 . . . . 0.0 111.444 -173.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.732 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 6.9 t -71.49 -35.49 70.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.709 1.604 . . . . 0.0 112.17 171.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.555 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 20.5 tt0 -65.81 -42.62 90.4 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.862 1.665 . . . . 0.0 110.129 168.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.73 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -70.95 -30.13 66.33 Favored 'General case' 0 C--N 1.355 0.823 0 C-N-CA 125.387 1.475 . . . . 0.0 111.167 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -67.44 -39.37 85.42 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.394 1.478 . . . . 0.0 110.353 166.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.98 -29.25 70.12 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.26 1.824 . . . . 0.0 111.778 173.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -83.33 -7.9 59.51 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.418 1.487 . . . . 0.0 111.42 173.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.77 46.12 11.67 Favored Glycine 0 CA--C 1.543 1.823 0 C-N-CA 125.665 1.602 . . . . 0.0 112.111 173.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.75 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 1.0 OUTLIER -101.29 -177.54 3.47 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.631 1.572 . . . . 0.0 110.991 172.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.27 161.7 39.6 Favored Pre-proline 0 CA--C 1.549 0.913 0 C-N-CA 125.92 1.688 . . . . 0.0 111.167 167.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.432 ' HB3' ' CG ' ' A' ' 73' ' ' GLN . 17.6 Cg_exo -68.19 145.63 67.2 Favored 'Trans proline' 0 CA--C 1.546 1.081 0 C-N-CA 124.468 3.446 . . . . 0.0 115.308 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t -69.46 150.82 46.8 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.206 2.202 . . . . 0.0 110.798 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 6.4 tppt? -76.51 3.28 11.65 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.132 1.373 . . . . 0.0 111.298 -171.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.41 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 4.0 ttt180 -137.46 -48.76 0.59 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.787 2.035 . . . . 0.0 111.194 -167.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.9 m -92.78 -38.17 11.93 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 126.297 1.839 . . . . 0.0 111.099 -164.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.432 ' CG ' ' HB3' ' A' ' 68' ' ' PRO . 7.5 tp60 -55.61 111.44 3.11 Favored Pre-proline 0 CA--C 1.554 1.101 0 CA-C-O 118.022 -0.989 . . . . 0.0 109.176 160.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -25.21 81.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.121 1 C-N-CA 126.597 4.865 . . . . 0.0 115.169 -162.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.1 t0 67.19 63.8 0.44 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.726 2.01 . . . . 0.0 111.263 172.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -90.87 25.64 2.33 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.029 1.332 . . . . 0.0 110.378 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -67.42 165.25 16.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.612 1.565 . . . . 0.0 111.273 -167.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -115.18 134.5 22.54 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.625 1.57 . . . . 0.0 110.988 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.41 97.87 0.72 Allowed 'Trans proline' 0 CA--C 1.546 1.09 0 C-N-CA 124.39 3.393 . . . . 0.0 112.565 170.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -20.74 -70.03 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.72 2.408 . . . . 0.0 112.399 170.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 44.8 40.04 3.96 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.868 1.667 . . . . 0.0 111.0 171.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 74.85 124.24 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.56 1.544 . . . . 0.0 111.387 177.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.91 99.8 0.14 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.653 1.581 . . . . 0.0 111.114 165.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.668 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.3 tt 179.54 122.2 0.06 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.379 1.872 . . . . 0.0 111.911 -173.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.668 ' N ' HD23 ' A' ' 84' ' ' LEU . 14.5 t0 27.8 -86.02 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 128.132 2.573 . . . . 0.0 112.368 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 163.59 151.06 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.657 1.583 . . . . 0.0 110.586 -168.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 46.2 mm -80.48 90.17 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.698 1.599 . . . . 0.0 109.0 -171.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.3 t -73.78 166.19 23.76 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.609 1.564 . . . . 0.0 110.041 -179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 71.47 169.08 0.32 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.644 1.577 . . . . 0.0 111.394 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -123.12 168.9 11.8 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.612 1.565 . . . . 0.0 110.699 -173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -84.29 123.61 30.35 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.619 1.568 . . . . 0.0 110.385 -172.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.3 ttt-85 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.607 1.563 . . . . 0.0 110.186 -178.978 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.725 -0.102 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -55.77 -26.64 46.88 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.63 1.572 . . . . 0.0 110.515 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.432 ' HG2' ' N ' ' A' ' 4' ' ' ALA . 12.1 ttmm -85.25 155.17 21.51 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.604 1.562 . . . . 0.0 110.5 -175.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.432 ' N ' ' HG2' ' A' ' 3' ' ' LYS . . . -47.94 114.69 0.97 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.6 1.56 . . . . 0.0 111.246 178.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 70.55 164.07 0.26 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.591 1.556 . . . . 0.0 110.049 171.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 11' ' ' GLN . 38.6 m -93.1 73.53 4.68 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.677 1.591 . . . . 0.0 110.386 -168.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.87 21.79 3.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.339 1.856 . . . . 0.0 110.915 -168.864 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 79.4 p -48.67 167.69 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.285 1.834 . . . . 0.0 110.851 176.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -68.25 -24.27 64.88 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.804 1.641 . . . . 0.0 111.339 -173.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -40.0 -68.79 0.15 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.043 1.337 . . . . 0.0 111.008 161.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.848 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -83.19 -18.75 38.22 Favored 'General case' 0 C--N 1.353 0.734 0 C-N-CA 123.995 0.918 . . . . 0.0 110.816 -166.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 1.7 mmt85 -45.18 -57.26 4.05 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-O 123.233 1.492 . . . . 0.0 109.547 160.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.774 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.9 t-105 -72.56 -19.22 61.54 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.91 177.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.848 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 3.3 mt-30 -68.19 -53.98 21.06 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.849 0.749 . . . . 0.0 110.458 171.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -27.39 66.61 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.988 1.315 . . . . 0.0 112.554 174.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.777 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.6 -35.07 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 C-N-CA 126.255 1.822 . . . . 0.0 110.453 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 17' ' ' LEU . 11.3 mt -67.82 -38.97 83.95 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.069 1.347 . . . . 0.0 110.608 175.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.59 -23.53 63.02 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.755 1.622 . . . . 0.0 110.666 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 73.17 20.42 3.36 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.66 1.584 . . . . 0.0 110.535 -176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.579 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 3.5 t0 -43.56 90.88 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 126.093 1.757 . . . . 0.0 110.672 -164.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 53.0 Cg_exo -55.84 -20.05 27.48 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 124.296 3.331 . . . . 0.0 112.956 -163.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -100.09 11.16 39.99 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.265 1.826 . . . . 0.0 111.273 -165.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.895 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -99.11 16.66 21.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.387 1.475 . . . . 0.0 111.397 -174.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.45 131.98 44.11 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.439 1.496 . . . . 0.0 111.17 164.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.73 -31.9 4.44 Favored Glycine 0 CA--C 1.544 1.863 0 C-N-CA 125.617 1.58 . . . . 0.0 112.052 -168.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.85 -34.76 71.98 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.63 1.572 . . . . 0.0 110.629 177.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 32.0 p90 -172.95 -178.22 1.77 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.973 1.309 . . . . 0.0 111.826 168.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.037 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.7 m -130.77 172.87 15.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 126.537 1.935 . . . . 0.0 109.309 160.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.604 ' HD2' HG21 ' A' ' 16' ' ' VAL . 0.1 OUTLIER -143.56 157.42 44.44 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.134 0.974 . . . . 0.0 111.815 169.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.64 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -132.09 108.17 9.13 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.432 1.893 . . . . 0.0 111.603 -161.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.704 HG22 HG23 ' A' ' 52' ' ' VAL . 92.0 t -88.95 96.44 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.31 1.444 . . . . 0.0 110.138 178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 -56.5 -29.19 61.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.357 1.463 . . . . 0.0 111.411 -166.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.52 -19.11 42.86 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.577 1.551 . . . . 0.0 110.917 -163.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.493 HG23 HG13 ' A' ' 36' ' ' ILE . 13.5 t -100.86 -29.77 12.05 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.54 1.536 . . . . 0.0 110.848 169.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.81 55.21 20.91 Favored Glycine 0 CA--C 1.542 1.763 0 C-N-CA 125.469 1.509 . . . . 0.0 111.622 -163.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.493 HG13 HG23 ' A' ' 34' ' ' THR . 34.5 mt -126.18 159.19 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 126.027 1.731 . . . . 0.0 109.961 170.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.838 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 36.6 p90 -133.0 143.92 49.75 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.599 1.56 . . . . 0.0 111.181 166.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 32.7 m -125.5 -175.46 3.33 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 126.877 2.071 . . . . 0.0 112.167 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.665 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 4.7 ttm180 -90.41 154.77 46.57 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 127.188 2.195 . . . . 0.0 109.094 157.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.895 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 4.9 Cg_endo -40.98 -24.42 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 124.695 3.597 . . . . 0.0 115.835 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.445 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 21.5 t -84.52 22.19 1.34 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 127.024 2.13 . . . . 0.0 113.292 -161.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.9 t -74.05 99.24 3.27 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.663 1.119 . . . . 0.0 110.513 -164.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -78.56 -24.13 45.76 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.234 1.813 . . . . 0.0 111.253 -163.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.625 ' HB2' ' NH2' ' A' ' 71' ' ' ARG . . . -46.06 151.33 0.49 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.409 1.483 . . . . 0.0 111.17 166.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.03 102.11 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.473 1.509 . . . . 0.0 110.941 173.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -45.85 145.35 1.47 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 111.545 -164.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -93.39 122.29 35.66 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.536 1.534 . . . . 0.0 110.893 161.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.422 ' HB2' ' ND2' ' A' ' 51' ' ' ASN . 53.2 mt -45.84 149.58 0.63 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.583 1.553 . . . . 0.0 111.251 -161.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -38.37 -50.74 1.51 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.847 2.059 . . . . 0.0 111.376 163.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -68.59 -17.52 64.14 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 126.114 1.766 . . . . 0.0 112.364 -168.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.422 ' ND2' ' HB2' ' A' ' 48' ' ' LEU . 66.7 m-20 -99.43 -23.3 15.17 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.614 1.566 . . . . 0.0 111.064 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.704 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -90.57 144.12 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 126.363 1.865 . . . . 0.0 110.481 -176.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.7 p -140.07 156.18 46.7 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.831 1.652 . . . . 0.0 111.604 167.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 55.8 m-85 -113.36 134.44 54.63 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.563 1.545 . . . . 0.0 112.568 -160.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.037 ' HB2' HG22 ' A' ' 28' ' ' VAL . 5.7 m-85 -112.17 179.79 3.9 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.163 2.985 . . . . 0.0 111.821 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.58 -40.61 25.49 Favored 'General case' 0 C--N 1.356 0.852 0 C-N-CA 125.888 1.675 . . . . 0.0 111.445 165.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -154.35 -178.89 7.45 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.685 1.594 . . . . 0.0 111.296 -173.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.838 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -79.87 -39.12 31.25 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.801 1.641 . . . . 0.0 111.599 -171.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.497 ' HA ' ' CG ' ' A' ' 62' ' ' LEU . 3.5 m -59.44 -13.61 9.29 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.051 1.74 . . . . 0.0 111.213 173.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.7 tp10 -75.72 -53.02 9.18 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.114 1.766 . . . . 0.0 110.419 166.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.728 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -65.51 -17.76 64.81 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.553 1.541 . . . . 0.0 111.009 173.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.497 ' CG ' ' HA ' ' A' ' 59' ' ' SER . 6.3 mt -70.95 -46.3 62.65 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.862 2.065 . . . . 0.0 110.496 166.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.68 -24.59 61.59 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.932 1.693 . . . . 0.0 111.287 172.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.29 -16.46 52.42 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.498 1.519 . . . . 0.0 111.746 171.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.58 38.67 27.56 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.776 1.655 . . . . 0.0 112.125 179.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.64 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.8 m-30 -103.5 166.06 10.65 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.714 1.606 . . . . 0.0 110.922 -179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.16 144.09 28.45 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.756 1.622 . . . . 0.0 111.428 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' HB2' ' HB3' ' A' ' 73' ' ' GLN . 37.2 Cg_endo -59.96 114.84 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.993 3.796 . . . . 0.0 115.267 172.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.489 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 39.3 t -48.62 150.81 1.28 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.622 1.969 . . . . 0.0 110.958 175.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -81.93 7.8 12.08 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.537 1.535 . . . . 0.0 110.952 -167.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.625 ' NH2' ' HB2' ' A' ' 44' ' ' ALA . 3.2 ttp180 -132.3 -48.0 0.91 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.277 1.831 . . . . 0.0 111.086 -165.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.26 -55.04 2.43 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 111.128 -165.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.505 ' HB3' ' HB2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -68.43 115.11 26.44 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.323 1.449 . . . . 0.0 110.196 164.333 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -40.32 91.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.117 1 C-N-CA 125.668 4.246 . . . . 0.0 113.433 -163.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -134.45 -60.78 0.79 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.272 1.829 . . . . 0.0 111.153 174.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.7 tttt -129.67 38.26 3.87 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.334 1.454 . . . . 0.0 110.346 171.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' O ' ' A' ' 71' ' ' ARG . . . -89.16 117.28 28.03 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.543 1.537 . . . . 0.0 111.212 164.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 72.37 119.14 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.656 1.582 . . . . 0.0 111.034 179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -71.31 136.51 29.11 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.368 3.378 . . . . 0.0 112.625 -179.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -18.0 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.935 2.494 . . . . 0.0 112.763 168.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 159.8 -52.85 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 127.668 2.387 . . . . 0.0 111.884 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 3.0 p80 43.32 85.91 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.004 1.722 . . . . 0.0 111.51 169.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -53.67 112.71 0.98 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.597 1.559 . . . . 0.0 111.13 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.631 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.3 OUTLIER 179.48 134.48 0.1 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.49 1.916 . . . . 0.0 111.904 -171.356 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.631 ' H ' HD23 ' A' ' 84' ' ' LEU . 3.0 t0 -151.07 -142.24 0.12 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.764 1.626 . . . . 0.0 111.089 -166.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.47 ' HE3' HG23 ' A' ' 87' ' ' ILE . 0.0 OUTLIER 90.16 -10.21 0.34 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.041 1.737 . . . . 0.0 110.802 163.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.47 HG23 ' HE3' ' A' ' 86' ' ' LYS . 0.4 OUTLIER -115.53 169.91 5.89 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 126.038 1.735 . . . . 0.0 108.953 165.037 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.5 p -69.38 -36.19 76.57 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.74 1.616 . . . . 0.0 110.028 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 83.33 23.57 0.14 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.62 1.568 . . . . 0.0 111.445 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -72.06 131.57 43.05 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.598 1.559 . . . . 0.0 110.695 177.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -158.44 145.07 17.41 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.626 1.57 . . . . 0.0 110.384 173.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.1 mtt85 . . . . . 0 N--CA 1.469 0.52 0 C-N-CA 125.559 1.543 . . . . 0.0 110.139 173.352 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 ptp . . . . . 0 CA--C 1.544 0.714 0 N-CA-C 110.733 -0.099 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.78 -98.13 0.12 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.652 1.581 . . . . 0.0 110.483 -178.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 38.41 49.37 1.35 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.602 1.561 . . . . 0.0 110.535 -170.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 45.17 80.92 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.595 1.558 . . . . 0.0 111.256 172.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.817 ' CG2' HD23 ' A' ' 7' ' ' LEU . 2.1 m -157.32 126.39 5.87 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.584 1.553 . . . . 0.0 110.011 -176.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 21.3 m -102.74 70.25 1.11 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.601 1.56 . . . . 0.0 110.379 -173.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.817 HD23 ' CG2' ' A' ' 5' ' ' THR . 0.5 OUTLIER -89.43 24.99 2.07 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.344 1.858 . . . . 0.0 110.91 -171.694 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 m -58.11 165.72 1.82 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.486 1.914 . . . . 0.0 110.749 170.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.422 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 1.1 p30 -65.65 -16.57 63.86 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.467 1.507 . . . . 0.0 111.328 -171.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -47.79 -79.82 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.57 1.548 . . . . 0.0 111.146 165.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -75.29 -18.89 59.95 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.211 1.004 . . . . 0.0 110.619 -170.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.445 HH21 HD12 ' A' ' 7' ' ' LEU . 12.9 mmt85 -42.41 -59.64 1.78 Allowed 'General case' 0 CA--C 1.551 1.011 0 CA-C-O 123.082 1.42 . . . . 0.0 109.747 159.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.711 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.7 t-105 -71.31 -17.95 62.43 Favored 'General case' 0 C--N 1.363 1.161 0 CA-C-N 113.869 -1.514 . . . . 0.0 111.768 176.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.838 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.59 -56.15 13.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 118.362 0.528 . . . . 0.0 110.52 168.879 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.4 m -50.99 -37.14 43.06 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.798 1.239 . . . . 0.0 112.18 171.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.758 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.5 t -89.76 -28.51 5.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 C-N-CA 126.37 1.868 . . . . 0.0 110.496 -171.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 13.3 mt -72.92 -39.38 66.33 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.152 1.381 . . . . 0.0 110.733 172.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.56 -21.27 37.47 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.6 1.56 . . . . 0.0 110.368 170.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 62.86 40.95 9.17 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 125.187 1.395 . . . . 0.0 110.688 -178.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -75.48 96.37 0.15 Allowed Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 125.949 1.7 . . . . 0.0 110.64 -162.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.426 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 32.0 Cg_exo -60.68 -17.12 47.58 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 124.097 3.198 . . . . 0.0 112.774 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -100.1 13.25 34.76 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.128 1.771 . . . . 0.0 111.565 -164.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.651 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -105.3 23.79 13.14 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.472 1.509 . . . . 0.0 110.962 163.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.869 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 6.0 t70 -67.36 93.34 0.32 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.744 1.617 . . . . 0.0 111.162 164.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 119.42 -19.37 9.89 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 125.608 1.575 . . . . 0.0 112.065 -173.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -41.41 74.2 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.757 1.623 . . . . 0.0 110.535 176.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.821 ' HE1' ' CG ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.69 -177.15 5.01 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.257 1.423 . . . . 0.0 111.53 173.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.042 HG22 ' HB2' ' A' ' 55' ' ' TYR . 1.4 m -129.75 172.71 15.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.111 1.765 . . . . 0.0 109.719 161.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 0.4 OUTLIER -142.43 156.46 45.19 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.603 1.161 . . . . 0.0 111.355 172.027 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.829 ' HB2' ' CE2' ' A' ' 55' ' ' TYR . . . -134.25 105.86 6.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.39 1.876 . . . . 0.0 111.56 -163.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.714 ' CG2' HG23 ' A' ' 52' ' ' VAL . 56.1 t -83.17 99.82 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 125.275 1.43 . . . . 0.0 110.062 176.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 3.8 mtm-85 -60.08 -19.71 54.54 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.642 1.577 . . . . 0.0 111.389 -166.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.491 HG22 ' CG1' ' A' ' 31' ' ' VAL . 4.3 t -86.6 -25.13 25.1 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.466 1.507 . . . . 0.0 110.832 -164.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.481 HG23 ' N ' ' A' ' 36' ' ' ILE . 8.9 t -100.77 -23.45 14.6 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.658 1.583 . . . . 0.0 110.857 174.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.54 51.5 53.79 Favored Glycine 0 CA--C 1.543 1.829 0 C-N-CA 125.347 1.451 . . . . 0.0 111.519 -163.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 34' ' ' THR . 21.0 mt -123.98 154.06 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.175 1.79 . . . . 0.0 109.934 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.889 ' HE2' ' CB ' ' A' ' 58' ' ' ALA . 1.3 p90 -135.09 143.54 46.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.397 1.479 . . . . 0.0 111.184 167.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.6 m -124.63 -176.5 3.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 127.377 2.271 . . . . 0.0 111.571 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.869 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.64 163.02 21.31 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 126.364 1.866 . . . . 0.0 109.503 158.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.821 ' CG ' ' HE1' ' A' ' 27' ' ' PHE . 18.7 Cg_endo -48.2 -22.28 3.66 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.518 3.479 . . . . 0.0 115.402 -169.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.426 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 5.4 t -90.28 20.27 4.54 Favored 'General case' 0 C--O 1.246 0.877 0 C-N-CA 126.174 1.79 . . . . 0.0 113.016 -160.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.6 t -67.9 98.56 0.75 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.949 1.25 . . . . 0.0 110.37 -162.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -64.24 -40.43 96.0 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.165 1.786 . . . . 0.0 111.206 -164.401 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.664 ' HB2' HH11 ' A' ' 71' ' ' ARG . . . -40.54 138.64 0.91 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.627 1.571 . . . . 0.0 111.199 165.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -58.66 81.15 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.411 1.484 . . . . 0.0 110.962 176.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.19 137.83 51.28 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.883 1.273 . . . . 0.0 111.157 -164.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -48.67 153.19 0.84 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.801 1.64 . . . . 0.0 111.237 167.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.1 160.2 10.53 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.505 1.522 . . . . 0.0 110.83 -164.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.3 OUTLIER -45.54 -35.33 3.84 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.104 1.761 . . . . 0.0 111.304 166.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -69.07 -16.89 63.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 125.623 1.569 . . . . 0.0 111.872 -168.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.445 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 67.3 m-20 -105.14 -21.47 13.26 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.341 1.856 . . . . 0.0 111.085 176.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.714 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -96.21 145.16 9.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 125.864 1.666 . . . . 0.0 110.154 -173.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 p -139.26 156.84 46.79 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.477 1.511 . . . . 0.0 111.847 170.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 48.8 m-85 -112.26 132.64 54.83 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.626 1.57 . . . . 0.0 112.316 -160.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.042 ' HB2' HG22 ' A' ' 28' ' ' VAL . 19.6 m-85 -107.55 178.6 4.49 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 129.094 2.957 . . . . 0.0 111.403 171.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.34 -36.87 29.16 Favored 'General case' 0 C--N 1.356 0.878 0 C-N-CA 125.932 1.693 . . . . 0.0 111.435 167.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.567 ' HA ' HG13 ' A' ' 28' ' ' VAL . 14.4 p30 -161.17 179.98 7.94 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.396 1.479 . . . . 0.0 111.346 -176.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.889 ' CB ' ' HE2' ' A' ' 37' ' ' PHE . . . -70.56 -32.54 70.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.976 1.71 . . . . 0.0 111.526 -171.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.469 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 t -66.18 -31.75 72.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.678 1.591 . . . . 0.0 111.421 -179.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.3 OUTLIER -68.03 -46.25 71.72 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.083 1.753 . . . . 0.0 110.037 170.671 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.942 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -66.59 -25.33 66.57 Favored 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.279 1.431 . . . . 0.0 110.898 175.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.469 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 7.6 mt -68.6 -39.67 80.79 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.912 2.085 . . . . 0.0 110.413 167.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.95 -28.36 70.02 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.182 1.793 . . . . 0.0 111.457 174.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -81.35 -11.26 59.36 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.423 1.489 . . . . 0.0 111.598 170.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 77.03 44.56 13.61 Favored Glycine 0 CA--C 1.544 1.855 0 C-N-CA 125.667 1.603 . . . . 0.0 112.12 172.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.575 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.9 OUTLIER -105.92 171.22 7.46 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.704 1.602 . . . . 0.0 110.966 179.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.31 146.6 39.85 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 125.832 1.653 . . . . 0.0 111.385 -175.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.425 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 4.2 Cg_exo -79.39 109.15 2.45 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 125.236 3.957 . . . . 0.0 114.982 -168.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 27.5 t -42.13 150.83 0.12 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.52 1.928 . . . . 0.0 110.842 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -79.94 5.83 12.89 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.315 1.446 . . . . 0.0 111.127 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.664 HH11 ' HB2' ' A' ' 44' ' ' ALA . 1.5 ttm180 -130.01 -46.6 1.13 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 126.448 1.899 . . . . 0.0 110.906 -164.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -104.0 -65.35 1.03 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.16 1.784 . . . . 0.0 111.174 -166.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.435 ' HB3' ' HD3' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -59.46 -52.56 73.38 Favored Pre-proline 0 CA--C 1.55 0.963 0 C-N-CA 125.292 1.437 . . . . 0.0 110.484 -164.79 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.435 ' HD3' ' HB3' ' A' ' 73' ' ' GLN . 59.2 Cg_endo -88.11 -32.83 0.14 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.9 3.734 . . . . 0.0 113.411 171.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.5 t0 75.25 60.61 0.06 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.146 1.778 . . . . 0.0 111.139 -163.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.7 ttmm -113.51 30.57 7.13 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.556 1.542 . . . . 0.0 110.248 -172.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -85.21 150.97 24.44 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.604 1.562 . . . . 0.0 111.224 166.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.07 117.84 68.52 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.612 1.565 . . . . 0.0 110.99 -172.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -46.96 -55.29 4.0 Favored 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.283 3.322 . . . . 0.0 112.49 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -14.76 -88.09 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 127.683 2.393 . . . . 0.0 112.653 163.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 72.97 51.97 0.14 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.098 1.759 . . . . 0.0 111.013 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 179.0 129.29 0.07 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.029 1.731 . . . . 0.0 111.391 164.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.21 54.74 3.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.805 1.242 . . . . 0.0 110.47 161.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.671 HD22 ' O ' ' A' ' 86' ' ' LYS . 2.5 tt -36.02 114.73 0.29 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.242 2.217 . . . . 0.0 112.167 -162.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.98 -69.08 0.35 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.525 1.53 . . . . 0.0 111.226 -177.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.671 ' O ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -38.7 155.86 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.745 1.618 . . . . 0.0 110.566 170.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.0 122.77 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.536 1.534 . . . . 0.0 108.963 171.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 20.5 m -70.11 -84.04 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.641 1.576 . . . . 0.0 110.086 -173.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 76.32 129.06 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.58 1.552 . . . . 0.0 111.396 167.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . 57.96 95.8 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.519 1.528 . . . . 0.0 110.712 172.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.56 84.33 0.18 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.618 1.567 . . . . 0.0 110.388 170.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 . . . . . 0 N--CA 1.47 0.536 0 C-N-CA 125.617 1.567 . . . . 0.0 110.142 -173.433 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ptm . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 110.712 -0.107 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.7 28.54 5.37 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.584 1.554 . . . . 0.0 110.491 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 2.4 ttpt -167.49 145.79 4.76 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.63 1.572 . . . . 0.0 110.551 -172.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 80.69 151.67 0.11 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.585 1.554 . . . . 0.0 111.256 174.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.9 t -157.38 -44.68 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.724 1.61 . . . . 0.0 110.029 -174.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.7 p 33.3 89.36 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.681 2.392 . . . . 0.0 111.151 174.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 21.43 3.58 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.361 1.864 . . . . 0.0 110.921 175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.6 p -52.84 172.45 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.106 1.762 . . . . 0.0 110.774 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.1 OUTLIER -80.0 -28.08 39.48 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.361 1.464 . . . . 0.0 111.317 -169.395 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -41.18 -73.03 0.05 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.319 1.447 . . . . 0.0 111.237 163.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.946 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -77.12 -23.89 51.73 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.051 0.94 . . . . 0.0 110.428 -168.172 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.527 ' HD3' ' CD1' ' A' ' 54' ' ' PHE . 22.5 mtt180 -40.19 -61.22 0.92 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.209 1.404 . . . . 0.0 110.41 160.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.823 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 37.2 t-105 -71.98 -15.03 62.05 Favored 'General case' 0 C--N 1.363 1.172 0 CA-C-N 114.85 -1.068 . . . . 0.0 112.103 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.946 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.46 -63.36 1.12 Allowed 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 118.945 0.793 . . . . 0.0 110.345 168.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 3.1 t -60.37 -16.21 33.17 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.899 1.28 . . . . 0.0 112.787 178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.823 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 72.1 t -88.05 -44.63 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 125.629 1.572 . . . . 0.0 111.266 170.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 6.3 mt -63.89 -39.15 93.52 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.848 1.259 . . . . 0.0 110.458 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.06 -22.77 61.28 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.769 1.627 . . . . 0.0 110.625 176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 78.49 24.25 0.62 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.116 1.766 . . . . 0.0 110.839 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 28.8 t70 -51.39 94.32 0.06 OUTLIER Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 125.847 1.659 . . . . 0.0 110.914 -163.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -57.81 -24.12 62.27 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.545 3.496 . . . . 0.0 113.084 -164.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -105.47 20.79 18.3 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.757 2.023 . . . . 0.0 110.908 -164.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.617 ' HB2' ' OD2' ' A' ' 20' ' ' ASP . . . -105.4 25.42 10.7 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.998 1.719 . . . . 0.0 110.939 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.612 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.01 -5.86 10.96 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.832 1.653 . . . . 0.0 112.402 169.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.75 -34.23 1.57 Allowed Glycine 0 CA--C 1.543 1.827 0 C-N-CA 125.632 1.586 . . . . 0.0 111.936 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -72.22 -38.66 68.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.787 1.635 . . . . 0.0 110.767 -172.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 40' ' ' PRO . 11.2 p90 -172.13 -177.16 1.8 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.177 1.391 . . . . 0.0 111.792 176.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.4 m -125.11 172.66 12.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 126.368 1.867 . . . . 0.0 109.402 160.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 29' ' ' PHE . 1.4 p90 -137.4 151.95 49.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.718 1.207 . . . . 0.0 111.599 169.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.59 117.39 18.66 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.398 1.879 . . . . 0.0 111.386 -163.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.658 ' CG1' HG22 ' A' ' 33' ' ' THR . 18.4 t -97.28 96.45 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 124.804 1.242 . . . . 0.0 110.065 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.0 -17.11 21.94 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.53 1.532 . . . . 0.0 111.415 -168.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.658 HG22 ' CG1' ' A' ' 31' ' ' VAL . 10.2 t -85.46 -30.44 23.5 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.499 1.52 . . . . 0.0 110.848 -169.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.859 HG23 HG13 ' A' ' 36' ' ' ILE . 4.2 t -100.37 -22.76 14.96 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.684 1.594 . . . . 0.0 110.847 176.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.51 39.31 96.74 Favored Glycine 0 CA--C 1.544 1.847 0 C-N-CA 125.541 1.543 . . . . 0.0 111.8 -172.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.859 HG13 HG23 ' A' ' 34' ' ' THR . 14.4 mt -110.58 161.58 8.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 125.954 1.702 . . . . 0.0 110.047 166.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.83 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 53.7 p90 -131.8 148.86 52.59 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.921 1.688 . . . . 0.0 111.013 164.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 74.6 m -130.4 172.1 12.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.33 2.252 . . . . 0.0 111.203 -170.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.856 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 16.8 ttm180 -88.62 155.72 50.67 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 126.25 1.82 . . . . 0.0 109.094 157.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.856 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 65.1 Cg_exo -54.97 -11.12 3.29 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.149 3.233 . . . . 0.0 116.075 -168.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -87.24 12.51 11.62 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 126.031 1.732 . . . . 0.0 112.67 -166.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.5 91.82 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.761 1.164 . . . . 0.0 110.52 -161.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.59 -50.95 67.42 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.027 1.731 . . . . 0.0 111.392 -161.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.559 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -47.65 121.2 3.84 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.261 1.425 . . . . 0.0 110.903 166.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.635 ' H ' ' HD2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -43.14 91.19 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.116 1.766 . . . . 0.0 111.458 -162.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.56 132.42 49.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.753 1.221 . . . . 0.0 111.117 -167.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -41.64 150.92 0.09 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.939 1.696 . . . . 0.0 111.242 174.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 48' ' ' LEU . 12.4 mt -54.4 156.41 3.33 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 110.77 -173.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.5 ' HB2' ' CG ' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -51.51 -27.13 9.81 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.23 1.812 . . . . 0.0 111.396 167.509 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -69.9 -17.83 63.37 Favored 'General case' 0 C--N 1.352 0.687 0 C-N-CA 125.914 1.686 . . . . 0.0 112.17 -173.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.54 11.49 12.91 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.115 1.766 . . . . 0.0 111.176 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.807 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 1.2 t -129.77 128.65 65.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.292 1.837 . . . . 0.0 109.945 -162.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 p -139.86 156.27 46.8 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.265 1.426 . . . . 0.0 111.99 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CD1' ' HD3' ' A' ' 12' ' ' ARG . 1.2 m-85 -111.83 135.86 51.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.555 1.542 . . . . 0.0 112.539 -160.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 5.0 m-85 -108.66 -179.77 3.96 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 129.145 2.978 . . . . 0.0 111.586 171.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.73 -38.74 22.87 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 125.637 1.575 . . . . 0.0 111.592 163.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.486 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 6.0 p30 -157.97 178.3 10.38 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.496 1.519 . . . . 0.0 111.508 -172.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.83 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.55 -20.52 43.27 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.231 1.812 . . . . 0.0 111.634 -167.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 0.7 OUTLIER -70.51 -35.65 73.33 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.856 1.663 . . . . 0.0 111.9 171.693 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.639 ' HB3' ' HD2' ' A' ' 55' ' ' TYR . 0.5 OUTLIER -65.78 -40.5 92.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.877 1.671 . . . . 0.0 110.099 168.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.622 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -67.9 -34.38 76.53 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.584 1.554 . . . . 0.0 110.935 174.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.457 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.4 mt -68.92 -38.43 79.53 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.513 1.925 . . . . 0.0 110.554 169.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.97 -26.06 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.264 1.826 . . . . 0.0 111.31 173.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.41 -11.39 58.58 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.727 1.611 . . . . 0.0 111.539 171.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.408 ' C ' ' HD1' ' A' ' 66' ' ' PHE . . . 84.78 33.62 18.13 Favored Glycine 0 CA--C 1.543 1.814 0 C-N-CA 125.774 1.654 . . . . 0.0 111.875 174.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.862 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.2 m-30 -104.15 169.2 8.63 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.856 1.662 . . . . 0.0 110.924 -178.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 67' ' ' ARG . 2.7 mmm-85 -125.32 148.8 62.22 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.616 1.566 . . . . 0.0 111.323 -174.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.478 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 5.2 Cg_exo -74.06 109.59 2.91 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 124.991 3.794 . . . . 0.0 114.865 -167.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.47 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 26.1 t -42.86 153.43 0.08 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.76 2.024 . . . . 0.0 110.782 -175.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.455 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 1.3 tppp? -79.94 6.33 11.56 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.4 1.48 . . . . 0.0 110.934 -168.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.96 -49.73 0.69 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.515 1.926 . . . . 0.0 111.144 -162.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -98.9 -56.26 2.48 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.925 1.69 . . . . 0.0 111.117 -167.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.489 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -74.32 133.08 78.12 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 125.339 1.456 . . . . 0.0 110.469 169.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -45.66 93.37 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.428 3.419 . . . . 0.0 113.109 -171.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.455 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 0.4 OUTLIER -142.91 -74.62 0.28 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.601 1.56 . . . . 0.0 111.202 -178.202 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -129.47 71.47 1.44 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.938 1.295 . . . . 0.0 110.231 168.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -78.55 174.68 11.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.848 1.659 . . . . 0.0 111.254 169.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.42 ' CG ' ' HD2' ' A' ' 79' ' ' PRO . 23.6 t30 85.82 142.84 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 125.775 1.63 . . . . 0.0 110.947 166.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 78' ' ' ASN . 71.9 Cg_endo -70.69 157.0 59.83 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.402 3.401 . . . . 0.0 112.585 -166.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.402 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 1.8 ttt180 24.7 -105.58 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.238 2.215 . . . . 0.0 112.128 -171.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.402 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 0.0 OUTLIER 47.67 62.55 2.4 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.822 1.649 . . . . 0.0 110.994 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 60.9 m-70 -90.58 -26.31 19.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.667 1.587 . . . . 0.0 111.434 179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 71.22 81.65 0.15 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.584 1.554 . . . . 0.0 111.132 -170.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 179.48 107.64 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.504 1.921 . . . . 0.0 111.939 -176.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.49 -60.84 1.76 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.61 1.564 . . . . 0.0 111.187 -171.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.88 38.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.581 1.552 . . . . 0.0 110.499 170.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.32 73.73 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.553 1.541 . . . . 0.0 108.932 169.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.1 p -58.72 163.27 3.4 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.593 1.557 . . . . 0.0 110.079 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.1 m80 -90.95 90.9 8.09 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.655 1.582 . . . . 0.0 111.397 -171.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -159.87 -75.12 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.564 1.546 . . . . 0.0 110.742 174.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 24.8 t -73.64 153.68 40.05 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.574 1.549 . . . . 0.0 110.371 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 125.555 1.542 . . . . 0.0 110.15 -179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mtm . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 120.3 0.095 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mmtt 48.91 56.79 7.2 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.61 1.564 . . . . 0.0 110.497 177.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 pttm -88.07 -29.94 20.27 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.605 1.562 . . . . 0.0 110.484 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 50.78 -92.43 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.61 1.564 . . . . 0.0 111.254 171.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.6 t -94.86 133.85 38.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.589 1.555 . . . . 0.0 110.057 -165.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.5 m -98.58 111.86 24.09 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.644 1.578 . . . . 0.0 110.41 -175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.778 HD12 ' NH1' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -89.61 23.33 2.67 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.398 1.879 . . . . 0.0 110.891 -179.094 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 9' ' ' ASP . 3.2 m -52.98 172.73 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.275 1.83 . . . . 0.0 110.817 173.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 8' ' ' THR . 1.9 p30 -62.72 -27.26 69.14 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.611 1.564 . . . . 0.0 111.384 -178.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -40.82 -74.93 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.338 1.455 . . . . 0.0 111.21 162.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.4 tt0 -74.15 -23.06 59.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.344 1.057 . . . . 0.0 110.797 -167.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.778 ' NH1' HD12 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -41.03 -60.36 1.23 Allowed 'General case' 0 CA--C 1.547 0.835 0 CA-C-O 123.049 1.404 . . . . 0.0 110.315 160.707 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.686 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 26.4 t-105 -69.78 -19.08 63.51 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.032 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -65.88 -59.36 3.93 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.065 0.848 . . . . 0.0 110.437 171.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.24 -28.21 57.69 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.751 1.22 . . . . 0.0 112.406 174.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.686 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.1 t -89.41 -30.8 5.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.184 1.794 . . . . 0.0 110.719 -177.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 9.9 mt -72.75 -40.7 65.81 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.103 1.361 . . . . 0.0 110.696 173.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.39 -19.99 57.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.873 1.669 . . . . 0.0 110.697 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 41' ' ' SER . 0.0 OUTLIER 59.7 21.04 9.75 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.799 1.64 . . . . 0.0 110.973 -170.293 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -51.76 90.9 0.03 OUTLIER Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 125.477 1.511 . . . . 0.0 110.698 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -64.15 -11.72 29.01 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 124.362 3.374 . . . . 0.0 112.799 -167.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -93.65 13.42 22.17 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.56 1.944 . . . . 0.0 111.498 -169.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.656 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -98.24 16.69 20.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.505 1.522 . . . . 0.0 111.345 165.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 4.5 p-10 -55.08 121.82 9.6 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.293 1.437 . . . . 0.0 111.034 162.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 87.45 -23.3 12.7 Favored Glycine 0 CA--C 1.542 1.769 0 C-N-CA 125.584 1.564 . . . . 0.0 112.062 -177.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -71.51 -33.73 69.47 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.52 1.528 . . . . 0.0 110.738 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 40' ' ' PRO . 18.1 p90 -169.44 -177.46 2.79 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.546 1.139 . . . . 0.0 112.372 170.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.782 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.0 m -133.8 170.34 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 127.076 2.151 . . . . 0.0 109.292 160.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HD1' ' O ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -139.9 158.92 43.29 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.218 1.007 . . . . 0.0 111.157 171.331 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.73 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -134.65 116.84 15.43 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 126.228 1.811 . . . . 0.0 111.416 -162.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.816 ' CG1' HG22 ' A' ' 33' ' ' THR . 72.2 t -92.76 108.56 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 125.455 1.502 . . . . 0.0 110.13 174.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.0 -26.52 60.39 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.733 1.613 . . . . 0.0 111.268 -175.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.4 t -84.98 -29.81 24.75 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.576 1.55 . . . . 0.0 110.817 -164.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.472 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 9.5 t -101.07 -24.79 14.23 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.632 1.573 . . . . 0.0 110.817 -179.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.3 46.8 92.09 Favored Glycine 0 CA--C 1.544 1.872 0 C-N-CA 125.523 1.535 . . . . 0.0 111.654 -166.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 44.6 mt -119.82 155.9 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 C-N-CA 126.231 1.813 . . . . 0.0 109.837 177.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.997 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.4 p90 -134.43 143.43 47.56 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.491 1.516 . . . . 0.0 110.829 164.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 4.2 m -124.81 -177.0 3.69 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 125.694 1.598 . . . . 0.0 112.791 174.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.964 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -85.06 151.88 57.9 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 127.016 2.127 . . . . 0.0 108.919 156.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.964 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 5.3 Cg_endo -42.27 -25.05 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 124.825 3.683 . . . . 0.0 116.02 -172.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.425 ' HA ' ' HA ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -80.01 11.64 3.25 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.758 2.023 . . . . 0.0 113.15 -160.749 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.8 91.89 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.587 1.085 . . . . 0.0 110.574 -163.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.752 ' HG2' ' HE ' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -69.22 -48.25 62.53 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.854 1.662 . . . . 0.0 111.428 -161.229 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' N ' ' CG ' ' A' ' 43' ' ' ARG . . . -41.44 124.45 2.4 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.37 1.468 . . . . 0.0 111.196 167.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 3.2 ttt-85 -43.33 107.69 0.09 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.883 1.673 . . . . 0.0 110.942 -169.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.2 169.99 4.08 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 124.681 1.192 . . . . 0.0 111.015 -162.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.05 140.38 29.7 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.795 1.638 . . . . 0.0 110.642 160.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.0 mt -47.38 150.99 0.81 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.521 1.528 . . . . 0.0 111.104 -162.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.52 -29.95 0.8 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.429 1.892 . . . . 0.0 111.438 166.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -76.79 -20.82 55.98 Favored 'General case' 0 C--N 1.353 0.722 0 C-N-CA 126.193 1.797 . . . . 0.0 112.137 -167.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -102.79 -7.89 21.26 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.444 1.898 . . . . 0.0 111.411 171.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.737 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -104.43 136.77 36.36 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 125.857 1.663 . . . . 0.0 110.123 -172.015 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.3 p -136.7 157.26 47.18 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.387 1.475 . . . . 0.0 111.725 173.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.527 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 46.3 m-85 -116.44 134.34 54.98 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.682 1.593 . . . . 0.0 112.328 -160.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.782 ' HB2' HG22 ' A' ' 28' ' ' VAL . 92.7 m-85 -117.97 -177.46 3.27 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 129.093 2.957 . . . . 0.0 111.663 177.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.39 -33.38 22.0 Favored 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.193 1.797 . . . . 0.0 111.434 172.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.725 ' OD1' ' HB2' ' A' ' 59' ' ' SER . 5.8 p30 -162.76 178.68 8.26 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.302 1.841 . . . . 0.0 111.068 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.997 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -87.54 -10.7 50.91 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.855 1.662 . . . . 0.0 111.764 -170.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.725 ' HB2' ' OD1' ' A' ' 57' ' ' ASN . 2.3 m -71.39 -36.18 71.3 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.836 1.654 . . . . 0.0 111.783 164.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.54 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.0 mt-10 -64.98 -42.87 94.15 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.981 1.712 . . . . 0.0 110.095 165.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.626 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -66.19 -32.75 74.37 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.084 1.353 . . . . 0.0 110.663 175.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.5 mt -70.57 -39.39 73.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.6 1.96 . . . . 0.0 110.655 167.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.82 -17.49 36.48 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.179 1.792 . . . . 0.0 111.114 168.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.626 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.68 -20.92 38.53 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.6 1.56 . . . . 0.0 111.722 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 109.74 -18.75 29.11 Favored Glycine 0 CA--C 1.547 2.033 0 C-N-CA 124.74 1.162 . . . . 0.0 113.167 -171.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.73 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 0.4 OUTLIER -80.25 171.78 14.63 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.048 1.739 . . . . 0.0 111.374 -161.063 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.474 ' HD2' ' HD2' ' A' ' 68' ' ' PRO . 2.4 mmm-85 -126.91 152.1 74.89 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 126.359 1.864 . . . . 0.0 111.36 -170.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' HD2' ' HD2' ' A' ' 67' ' ' ARG . 40.9 Cg_endo -61.56 127.55 22.08 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 124.453 3.435 . . . . 0.0 115.216 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.443 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 51.1 t -58.66 148.79 27.86 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.897 2.079 . . . . 0.0 110.824 175.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -79.11 4.86 13.43 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.368 1.467 . . . . 0.0 111.073 -172.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.752 ' HE ' ' HG2' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -130.13 -45.79 1.13 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.399 1.88 . . . . 0.0 111.04 -163.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.461 ' CB ' ' HB3' ' A' ' 38' ' ' CYS . 11.0 m -106.07 -53.65 2.6 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.105 1.762 . . . . 0.0 111.464 -163.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.779 ' HG2' ' HE1' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -72.99 128.46 87.9 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 125.054 1.342 . . . . 0.0 110.218 168.154 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -34.78 90.49 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.065 1 C-N-CA 126.071 4.514 . . . . 0.0 113.975 -174.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -150.33 -79.23 0.13 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.804 1.642 . . . . 0.0 111.216 -169.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.16 64.1 1.1 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.287 1.435 . . . . 0.0 110.357 -178.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 71' ' ' ARG . . . -81.65 120.21 24.81 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.426 1.491 . . . . 0.0 111.258 164.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.568 ' ND2' ' HD2' ' A' ' 79' ' ' PRO . 12.4 t-20 -167.2 138.55 2.59 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 125.485 1.514 . . . . 0.0 110.998 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.568 ' HD2' ' ND2' ' A' ' 78' ' ' ASN . 64.6 Cg_endo -81.33 47.54 2.58 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.57 3.513 . . . . 0.0 113.037 172.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.5 -73.1 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 127.789 2.436 . . . . 0.0 112.482 170.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 48.05 -94.55 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.789 1.636 . . . . 0.0 111.022 178.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 6.5 m80 -57.02 153.28 11.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.587 1.555 . . . . 0.0 111.469 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.98 60.56 5.52 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.025 1.33 . . . . 0.0 110.429 161.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.77 ' O ' HD23 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -44.96 165.33 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.597 2.359 . . . . 0.0 113.108 -172.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -133.06 -65.26 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 C-N-CA 125.511 1.524 . . . . 0.0 111.223 -171.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.5 mmtt 64.35 27.23 13.7 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 0.0 110.571 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -140.91 128.85 23.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 125.63 1.572 . . . . 0.0 108.996 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.8 m -87.57 -61.97 1.6 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.601 1.56 . . . . 0.0 110.054 -174.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.446 ' O ' ' HB3' ' A' ' 90' ' ' ALA . 0.0 OUTLIER -95.2 59.22 2.21 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.655 1.582 . . . . 0.0 111.415 -170.645 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 89' ' ' HIS . . . 82.58 120.97 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.587 1.555 . . . . 0.0 110.713 170.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 8.2 p -91.0 -26.46 19.2 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.637 1.575 . . . . 0.0 110.412 176.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 4.0 tpp85 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.625 1.57 . . . . 0.0 110.147 174.729 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 CA-C-O 120.714 0.292 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 tttt 78.18 -70.69 0.11 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.784 1.634 . . . . 0.0 110.552 -177.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 tttt 74.1 73.88 0.12 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.559 1.544 . . . . 0.0 110.519 170.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -43.4 98.06 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.616 1.567 . . . . 0.0 111.275 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.4 m -147.96 139.8 23.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.59 1.556 . . . . 0.0 110.035 172.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.8 m -108.13 102.99 12.1 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.65 1.58 . . . . 0.0 110.389 176.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.588 HD13 HH12 ' A' ' 12' ' ' ARG . 0.2 OUTLIER -89.53 23.74 2.51 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.407 1.883 . . . . 0.0 110.924 174.221 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 82.2 p -56.39 145.31 27.7 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.343 1.857 . . . . 0.0 110.799 175.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.462 ' HB3' HH12 ' A' ' 49' ' ' ARG . 17.4 m-20 -57.73 -24.48 57.14 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.514 1.526 . . . . 0.0 111.325 177.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -43.39 -77.64 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.393 1.477 . . . . 0.0 111.193 163.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.675 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 1.7 tt0 -74.97 -21.81 58.94 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.262 1.025 . . . . 0.0 110.769 -168.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.588 HH12 HD13 ' A' ' 7' ' ' LEU . 6.1 mmp_? -41.61 -60.05 1.44 Allowed 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 122.804 1.288 . . . . 0.0 110.134 160.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.691 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 33.6 t-105 -67.57 -20.38 65.38 Favored 'General case' 0 C--N 1.363 1.192 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.799 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.675 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.06 -64.74 0.85 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 118.411 0.55 . . . . 0.0 110.401 168.098 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.5 t -60.04 -18.33 45.69 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.514 1.125 . . . . 0.0 112.773 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.691 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 3.9 t -89.78 -37.81 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 126.318 1.847 . . . . 0.0 110.478 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.449 HD23 ' HA ' ' A' ' 17' ' ' LEU . 6.1 mt -67.84 -37.68 82.21 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.314 1.446 . . . . 0.0 110.595 174.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.48 -16.41 60.59 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.298 1.839 . . . . 0.0 111.028 170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 55.33 32.41 18.67 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.798 1.639 . . . . 0.0 110.648 178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -52.07 93.99 0.06 OUTLIER Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 125.923 1.689 . . . . 0.0 110.581 -171.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 43.8 Cg_exo -59.25 -15.34 28.54 Favored 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.312 3.342 . . . . 0.0 113.185 -163.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -97.82 10.29 40.53 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.074 1.75 . . . . 0.0 111.229 -166.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.849 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -107.39 24.52 12.74 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.478 1.511 . . . . 0.0 111.139 -172.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 18.5 t0 -71.24 5.21 2.3 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.546 1.539 . . . . 0.0 111.884 168.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -119.28 -23.76 3.12 Favored Glycine 0 CA--C 1.544 1.85 0 C-N-CA 125.591 1.567 . . . . 0.0 112.001 167.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.552 ' HB3' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -73.95 -42.11 61.02 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.995 1.718 . . . . 0.0 110.901 -168.615 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HD1' ' HB3' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -169.98 -176.55 2.33 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.269 1.428 . . . . 0.0 111.496 173.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.0 m -127.38 171.02 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.8 1.64 . . . . 0.0 109.521 161.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.534 ' CD1' ' CG2' ' A' ' 52' ' ' VAL . 31.6 p90 -139.46 151.2 46.02 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.542 1.137 . . . . 0.0 111.169 171.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.49 110.85 11.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.288 1.835 . . . . 0.0 111.399 -162.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.612 HG21 ' HB3' ' A' ' 47' ' ' ALA . 72.0 t -86.79 102.41 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.33 1.452 . . . . 0.0 110.02 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -58.59 -19.43 38.32 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.367 1.467 . . . . 0.0 111.378 -170.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 t -102.61 -12.65 17.57 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.487 1.515 . . . . 0.0 111.12 -162.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.615 HG23 ' H ' ' A' ' 36' ' ' ILE . 10.1 t -100.68 -26.44 13.8 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.622 1.569 . . . . 0.0 110.82 167.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.653 ' HA2' ' HD1' ' A' ' 66' ' ' PHE . . . 63.14 46.68 92.71 Favored Glycine 0 CA--C 1.543 1.792 0 C-N-CA 125.47 1.51 . . . . 0.0 111.836 -162.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.615 ' H ' HG23 ' A' ' 34' ' ' THR . 41.7 mt -125.01 157.96 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 126.045 1.738 . . . . 0.0 109.956 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.845 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 52.1 p90 -132.51 157.86 43.57 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.521 1.528 . . . . 0.0 111.465 165.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 94.7 m -142.04 171.7 13.69 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.518 2.327 . . . . 0.0 110.965 -166.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG2' ' CD ' ' A' ' 40' ' ' PRO . 6.7 ttm180 -90.16 152.88 46.5 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.761 2.025 . . . . 0.0 109.143 158.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.849 ' HG2' ' HB3' ' A' ' 23' ' ' ALA . 2.0 Cg_endo -40.85 -24.37 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.763 3.642 . . . . 0.0 115.7 -178.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.0 t -85.28 17.93 2.86 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 126.787 2.035 . . . . 0.0 113.363 -161.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 6.4 t -67.69 85.96 0.21 Allowed 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 119.934 1.243 . . . . 0.0 110.256 -164.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.533 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -60.45 -49.97 75.45 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.056 1.742 . . . . 0.0 111.439 -161.138 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.623 ' HB2' ' NH1' ' A' ' 71' ' ' ARG . . . -53.94 126.53 22.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.199 1.4 . . . . 0.0 110.893 170.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ptt85 -43.24 121.02 2.04 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.907 1.683 . . . . 0.0 110.901 -164.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.8 161.45 30.94 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.13 1.372 . . . . 0.0 111.157 -161.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.612 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -76.5 131.53 39.06 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.274 1.43 . . . . 0.0 110.626 161.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 33.4 mt -47.26 152.79 0.55 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.53 1.532 . . . . 0.0 111.048 -161.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.469 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 1.2 ttt85 -38.74 -52.43 1.69 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.769 2.028 . . . . 0.0 111.398 162.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -61.57 -18.41 59.16 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.176 1.79 . . . . 0.0 112.221 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.3 m-20 -109.38 -21.34 12.56 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.554 1.941 . . . . 0.0 111.19 -179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.59 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.5 OUTLIER -89.02 142.81 12.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.744 2.018 . . . . 0.0 110.29 179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.5 p -140.14 156.85 46.37 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.618 1.567 . . . . 0.0 111.583 170.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.541 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 62.9 m-85 -112.48 129.32 56.38 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.544 1.538 . . . . 0.0 112.433 -160.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 24.7 m-85 -103.88 179.47 4.26 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 128.914 2.885 . . . . 0.0 111.702 169.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.49 -43.62 26.56 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 125.862 1.665 . . . . 0.0 111.811 165.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.495 ' C ' HG11 ' A' ' 28' ' ' VAL . 10.7 p30 -149.18 179.65 7.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.107 1.363 . . . . 0.0 111.325 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -64.18 -41.1 97.25 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.353 1.461 . . . . 0.0 111.368 -175.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 8.7 m -65.64 -26.99 68.06 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.841 1.656 . . . . 0.0 111.49 -170.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.46 ' HB3' ' HB3' ' A' ' 55' ' ' TYR . 2.9 tt0 -66.66 -44.44 81.87 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.806 1.642 . . . . 0.0 110.083 168.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.755 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -67.35 -31.91 72.48 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.183 1.393 . . . . 0.0 110.868 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.7 mt -71.64 -39.13 70.59 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.644 1.978 . . . . 0.0 110.575 169.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.76 -20.78 65.3 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.889 1.676 . . . . 0.0 111.118 170.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.641 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -88.35 -7.96 55.85 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.712 1.605 . . . . 0.0 111.598 177.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.05 -19.54 22.75 Favored Glycine 0 CA--C 1.547 2.036 0 C-N-CA 124.712 1.149 . . . . 0.0 113.042 178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.653 ' HD1' ' HA2' ' A' ' 35' ' ' GLY . 56.8 m-85 -81.58 157.1 24.87 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.054 1.742 . . . . 0.0 111.497 -160.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.35 164.86 14.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 126.291 1.836 . . . . 0.0 111.426 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.509 ' CB ' ' CG ' ' A' ' 73' ' ' GLN . 88.7 Cg_endo -80.8 122.46 4.38 Favored 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.439 3.426 . . . . 0.0 115.609 -167.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.456 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 36.2 t -50.82 152.13 2.21 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.465 1.906 . . . . 0.0 110.816 177.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' CB ' ' A' ' 76' ' ' LYS . 18.7 ttmt -88.49 17.74 5.11 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.035 1.734 . . . . 0.0 110.275 -169.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.623 ' NH1' ' HB2' ' A' ' 44' ' ' ALA . 1.1 tpp180 -137.45 -64.61 0.55 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 127.814 2.446 . . . . 0.0 110.017 -160.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.3 m -91.92 -60.21 1.92 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 125.901 1.68 . . . . 0.0 111.245 -169.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' CG ' ' CB ' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -47.73 129.3 11.17 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 124.2 1.0 . . . . 0.0 109.688 168.706 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -33.53 82.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.546 1.09 1 C-N-CA 126.272 4.648 . . . . 0.0 115.818 -162.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.3 t70 58.57 56.76 4.1 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.079 1.752 . . . . 0.0 111.129 160.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.528 ' HA ' ' HE3' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -81.49 4.5 20.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.476 1.11 . . . . 0.0 110.666 175.359 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.463 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -78.46 169.55 18.08 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.64 1.576 . . . . 0.0 111.444 -166.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -102.12 80.43 0.3 Allowed Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.831 1.652 . . . . 0.0 111.023 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 76.1 Cg_exo -55.3 96.55 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 124.317 3.345 . . . . 0.0 112.581 -165.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.76 -72.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.713 2.405 . . . . 0.0 112.371 168.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 54.51 -176.72 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.982 1.713 . . . . 0.0 110.981 177.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -24.54 15.33 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.634 1.574 . . . . 0.0 111.371 176.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.0 mtm180 65.03 87.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.599 1.559 . . . . 0.0 111.114 -178.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.441 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER 179.52 127.0 0.07 Allowed 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.513 1.925 . . . . 0.0 111.921 -176.107 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.441 ' H ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -119.55 -84.77 0.66 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.614 1.566 . . . . 0.0 111.189 -167.292 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -40.17 115.52 0.55 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.836 1.654 . . . . 0.0 110.627 177.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.472 ' O ' HG22 ' A' ' 87' ' ' ILE . 64.1 mt 56.78 89.32 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 125.567 1.547 . . . . 0.0 108.978 165.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.1 p -62.45 172.68 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.587 1.555 . . . . 0.0 110.062 171.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.96 39.74 3.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.578 1.551 . . . . 0.0 111.442 -170.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -92.26 121.3 33.64 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.555 1.542 . . . . 0.0 110.705 176.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -127.16 -71.48 0.67 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.609 1.564 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.0 ttt180 . . . . . 0 N--CA 1.47 0.538 0 C-N-CA 125.571 1.548 . . . . 0.0 110.161 -178.542 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.2 mtt . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.376 0.131 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 tptt 52.54 96.2 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.614 1.566 . . . . 0.0 110.501 -171.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 14.9 mttm 39.49 -108.41 0.08 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.959 1.703 . . . . 0.0 110.4 -165.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 3' ' ' LYS . . . 158.13 -152.76 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.594 1.558 . . . . 0.0 111.351 -164.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.2 m 89.03 34.65 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.019 1.728 . . . . 0.0 110.122 164.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 65.5 76.39 0.33 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.573 1.549 . . . . 0.0 110.584 164.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.67 19.5 4.62 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.369 1.868 . . . . 0.0 110.973 -175.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.472 HG22 ' OD1' ' A' ' 9' ' ' ASP . 2.5 m -59.15 170.93 0.81 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.333 1.853 . . . . 0.0 110.875 -175.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.514 ' HB2' ' NH1' ' A' ' 49' ' ' ARG . 1.3 p30 -60.22 -27.31 67.08 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.185 1.394 . . . . 0.0 111.292 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -43.9 -75.8 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.273 1.429 . . . . 0.0 111.024 161.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.93 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -76.49 -20.07 57.35 Favored 'General case' 0 C--N 1.352 0.696 0 C-N-CA 124.145 0.978 . . . . 0.0 110.896 -169.575 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 9.0 mmt85 -43.08 -58.8 2.3 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 123.137 1.446 . . . . 0.0 109.946 160.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.721 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 36.6 t-105 -72.2 -16.75 61.96 Favored 'General case' 0 C--N 1.364 1.235 0 CA-C-N 114.228 -1.351 . . . . 0.0 111.849 176.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.93 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 2.6 tp60 -66.88 -55.32 15.23 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 118.64 0.655 . . . . 0.0 110.517 169.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 0.3 OUTLIER -49.11 -38.98 26.61 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.139 1.375 . . . . 0.0 112.293 170.413 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.771 HG22 ' HA ' ' A' ' 40' ' ' PRO . 3.9 t -89.55 -26.98 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 126.2 1.8 . . . . 0.0 110.63 -171.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.46 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.8 mt -74.89 -38.95 61.75 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.14 1.376 . . . . 0.0 110.605 169.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.405 ' C ' ' HG2' ' A' ' 19' ' ' ARG . . . -63.28 -13.85 43.0 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.304 1.841 . . . . 0.0 110.984 168.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.405 ' HG2' ' C ' ' A' ' 18' ' ' ALA . 6.0 ptt180 51.49 23.95 2.04 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.788 1.635 . . . . 0.0 110.652 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -45.0 94.38 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.963 1.705 . . . . 0.0 110.888 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.434 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 57.2 Cg_endo -63.51 -28.89 70.6 Favored 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.221 3.28 . . . . 0.0 112.807 -169.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -77.09 -1.45 29.14 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.979 2.112 . . . . 0.0 111.456 -171.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.515 ' HB1' ' HE1' ' A' ' 27' ' ' PHE . . . -95.44 12.34 29.67 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.423 1.489 . . . . 0.0 111.26 172.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 3.4 p30 -55.68 -19.91 12.36 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.951 1.3 . . . . 0.0 112.431 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.78 -20.79 9.1 Favored Glycine 0 CA--C 1.544 1.89 0 C-N-CA 125.827 1.68 . . . . 0.0 111.735 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -72.92 -40.3 65.58 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.819 1.648 . . . . 0.0 110.812 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.574 ' N ' ' HD1' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -162.77 179.55 7.57 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.591 1.156 . . . . 0.0 112.394 -174.33 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.012 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.4 m -123.35 172.57 10.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 126.943 2.097 . . . . 0.0 109.416 160.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.551 ' HD1' ' CG2' ' A' ' 52' ' ' VAL . 10.3 p90 -134.63 142.84 47.0 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.631 1.172 . . . . 0.0 111.139 167.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.851 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -127.23 107.11 9.72 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.325 1.85 . . . . 0.0 111.298 -164.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.742 HG21 ' HB3' ' A' ' 47' ' ' ALA . 55.6 t -83.3 93.42 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.442 . . . . 0.0 109.969 175.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 1.6 ptt-85 -70.21 -3.92 19.24 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.577 1.551 . . . . 0.0 111.71 -169.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -100.76 -15.74 17.56 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.42 1.488 . . . . 0.0 110.812 -174.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.629 HG22 HG12 ' A' ' 31' ' ' VAL . 9.9 t -100.5 -25.24 14.26 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.666 1.586 . . . . 0.0 110.831 165.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.76 51.71 53.83 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.377 1.465 . . . . 0.0 111.42 -161.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.572 ' N ' HG23 ' A' ' 34' ' ' THR . 37.8 mt -122.29 156.33 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.229 1.812 . . . . 0.0 109.922 172.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.977 ' HD2' ' HB3' ' A' ' 61' ' ' ALA . 0.1 OUTLIER -131.42 159.83 36.86 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.205 1.402 . . . . 0.0 111.462 163.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 69.4 m -143.99 176.22 9.45 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 127.225 2.21 . . . . 0.0 110.707 -163.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.687 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.79 155.62 38.24 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.777 2.031 . . . . 0.0 109.834 162.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.771 ' HA ' HG22 ' A' ' 16' ' ' VAL . 11.7 Cg_endo -44.94 -27.5 2.56 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 124.121 3.214 . . . . 0.0 114.675 -177.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.434 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -90.08 5.69 45.63 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.455 1.902 . . . . 0.0 112.396 -161.049 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 45.7 t -45.89 100.81 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.802 1.241 . . . . 0.0 111.296 -160.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.66 -32.74 72.8 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.102 1.761 . . . . 0.0 111.104 -169.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 154.44 27.98 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 111.263 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.62 132.42 14.0 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.537 1.535 . . . . 0.0 111.066 -174.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 21.7 m170 -70.99 143.54 50.77 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.675 1.59 . . . . 0.0 111.486 -168.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.742 ' HB3' HG21 ' A' ' 31' ' ' VAL . . . -101.28 128.63 47.34 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.532 1.533 . . . . 0.0 111.046 162.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.8 mt -46.34 146.97 1.24 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.674 1.589 . . . . 0.0 110.99 -163.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH1' ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -44.5 -40.2 5.42 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.985 1.714 . . . . 0.0 111.298 168.366 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -73.14 -17.14 61.42 Favored 'General case' 0 C--N 1.351 0.666 0 C-N-CA 125.909 1.684 . . . . 0.0 111.889 -168.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -100.52 -21.69 15.24 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.747 2.019 . . . . 0.0 111.096 172.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.551 ' CG2' ' HD1' ' A' ' 29' ' ' PHE . 0.5 OUTLIER -92.88 140.87 15.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 126.083 1.753 . . . . 0.0 110.136 -173.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.7 p -139.55 157.05 46.47 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.408 1.483 . . . . 0.0 111.744 170.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.511 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 40.6 m-85 -113.67 130.77 56.35 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.569 1.548 . . . . 0.0 112.086 -161.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.061 ' CD2' ' HB2' ' A' ' 61' ' ' ALA . 13.1 m-85 -111.34 -179.43 3.72 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 129.184 2.994 . . . . 0.0 111.315 177.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.24 -45.7 31.58 Favored 'General case' 0 C--N 1.356 0.85 0 C-N-CA 125.578 1.551 . . . . 0.0 111.469 165.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.569 ' HA ' HG13 ' A' ' 28' ' ' VAL . 6.6 p30 -156.45 178.6 10.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.666 1.587 . . . . 0.0 111.153 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.886 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -75.3 -14.43 60.5 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.235 1.414 . . . . 0.0 111.623 -174.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.556 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 8.4 t -71.92 -37.51 70.05 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.476 1.51 . . . . 0.0 111.995 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.697 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 1.4 tm-20 -64.77 -41.57 95.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.327 1.451 . . . . 0.0 109.814 169.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 1.061 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -77.01 -24.42 52.15 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 124.613 1.165 . . . . 0.0 111.216 178.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -68.44 -38.53 81.25 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.271 1.429 . . . . 0.0 110.463 162.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -60.34 -24.35 64.97 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.786 1.634 . . . . 0.0 111.364 168.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -81.8 -16.26 51.5 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.553 1.541 . . . . 0.0 111.717 171.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.93 50.5 10.79 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 125.749 1.642 . . . . 0.0 112.282 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.851 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 2.9 m-30 -107.19 165.23 11.53 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.575 1.55 . . . . 0.0 110.922 177.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -112.38 156.35 42.3 Favored Pre-proline 0 CA--C 1.55 0.942 0 C-N-CA 125.925 1.69 . . . . 0.0 111.382 176.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.525 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.9 Cg_endo -84.64 122.24 2.68 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 C-N-CA 125.0 3.8 . . . . 0.0 115.494 -169.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 31.9 t -46.21 145.46 1.64 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 127.126 2.17 . . . . 0.0 110.335 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.426 ' HG3' ' HB3' ' A' ' 76' ' ' LYS . 2.4 ttmt -67.95 -5.83 19.05 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.645 1.578 . . . . 0.0 111.455 -173.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -122.53 -55.99 1.81 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 128.483 2.713 . . . . 0.0 109.214 -162.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 57.0 m -80.77 -65.27 1.03 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 126.758 2.023 . . . . 0.0 111.859 -165.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.542 ' HG2' ' CE1' ' A' ' 37' ' ' PHE . 0.5 OUTLIER -78.78 -59.16 0.68 Allowed Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 125.097 1.359 . . . . 0.0 111.427 -159.402 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.431 ' HD3' ' CB ' ' A' ' 73' ' ' GLN . 85.0 Cg_endo -86.76 -22.17 1.99 Allowed 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.125 3.883 . . . . 0.0 113.003 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.0 t0 66.86 59.15 0.57 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.543 1.537 . . . . 0.0 110.966 -162.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.426 ' HB3' ' HG3' ' A' ' 70' ' ' LYS . 0.5 OUTLIER -83.38 150.59 25.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.977 1.311 . . . . 0.0 110.263 -162.317 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -88.89 158.1 18.2 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.746 1.618 . . . . 0.0 111.251 -175.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.434 ' HB2' ' HD2' ' A' ' 79' ' ' PRO . 18.2 p30 -57.77 168.68 1.03 Allowed Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.595 1.558 . . . . 0.0 110.978 -177.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' A' ' 78' ' ' ASN . 84.9 Cg_exo -47.07 108.24 0.15 Allowed 'Trans proline' 0 CA--C 1.547 1.126 0 C-N-CA 124.314 3.342 . . . . 0.0 112.563 176.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.42 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 2.9 ttm-85 23.56 -109.65 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 127.278 2.231 . . . . 0.0 111.772 -168.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.42 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 1.6 tt0 31.05 73.83 0.05 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.105 2.162 . . . . 0.0 111.616 -178.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -60.65 -28.21 68.39 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.366 1.466 . . . . 0.0 111.374 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 53.67 99.14 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.551 1.54 . . . . 0.0 111.09 -164.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.409 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.2 OUTLIER 179.49 116.27 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.475 1.91 . . . . 0.0 111.943 -171.052 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.409 ' N ' HD22 ' A' ' 84' ' ' LEU . 1.8 p-10 -63.07 -156.75 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.228 1.811 . . . . 0.0 111.251 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.3 mttt 163.44 88.31 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.728 1.611 . . . . 0.0 110.512 -171.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.2 mt -100.96 149.56 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.617 1.567 . . . . 0.0 108.95 -171.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.4 p -78.32 -167.32 1.02 Allowed 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.624 1.569 . . . . 0.0 110.024 175.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -100.01 -30.36 12.03 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.611 1.565 . . . . 0.0 111.405 -170.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -131.92 143.51 50.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.572 1.549 . . . . 0.0 110.742 -173.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.33 158.7 17.25 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.594 1.558 . . . . 0.0 110.345 -179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.546 1.538 . . . . 0.0 110.144 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.747 0 N-CA-C 110.713 -0.106 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 26.6 mttp -134.06 -164.34 1.49 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.591 1.557 . . . . 0.0 110.508 -172.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.9 mtpt 69.3 115.67 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.59 1.556 . . . . 0.0 110.555 178.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 67.44 112.37 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.591 1.556 . . . . 0.0 111.281 -170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.3 95.53 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.592 1.557 . . . . 0.0 110.051 -167.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 m -122.18 131.96 54.21 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.585 1.554 . . . . 0.0 110.342 -170.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.463 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.2 OUTLIER -89.66 22.65 2.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 126.353 1.861 . . . . 0.0 110.916 174.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.5 p -51.75 146.95 7.25 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 126.295 1.838 . . . . 0.0 110.81 174.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HA ' ' HB2' ' A' ' 12' ' ' ARG . 0.8 OUTLIER -57.17 -23.68 49.18 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.497 1.519 . . . . 0.0 111.418 -170.163 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.444 ' O ' ' N ' ' A' ' 14' ' ' GLN . 3.5 m-20 -45.73 -69.44 0.13 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.526 1.53 . . . . 0.0 111.46 169.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.97 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tp-100 -81.59 -21.63 38.24 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.711 2.004 . . . . 0.0 111.002 -170.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 22.2 mtt180 -41.33 -62.24 0.89 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 123.606 1.67 . . . . 0.0 109.664 156.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.867 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 14.1 t-105 -82.04 -25.28 34.77 Favored 'General case' 0 C--N 1.365 1.242 0 CA-C-N 114.26 -1.337 . . . . 0.0 113.462 174.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.97 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -75.32 -45.6 38.56 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 120.868 1.667 . . . . 0.0 109.59 -178.029 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.714 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 2.4 m -46.88 -61.18 1.98 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.288 1.035 . . . . 0.0 111.055 159.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.867 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 4.1 t -61.35 -31.65 50.96 Favored 'Isoleucine or valine' 0 C--N 1.355 0.84 0 C-N-CA 124.605 1.162 . . . . 0.0 110.86 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.431 ' N ' ' O ' ' A' ' 13' ' ' TRP . 10.7 mt -74.17 -37.54 63.95 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.986 1.314 . . . . 0.0 110.197 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.47 -21.69 60.46 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.98 1.712 . . . . 0.0 110.583 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.8 ttm105 75.16 29.38 0.95 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.488 1.515 . . . . 0.0 110.827 -176.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -59.66 96.07 0.07 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 125.863 1.665 . . . . 0.0 110.721 -162.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 41' ' ' SER . 44.5 Cg_endo -64.26 -27.95 64.01 Favored 'Trans proline' 0 CA--C 1.546 1.101 0 C-N-CA 123.951 3.101 . . . . 0.0 112.713 -163.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -97.03 14.9 24.04 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.841 2.056 . . . . 0.0 111.395 -170.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -101.49 19.72 17.38 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 111.155 169.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.56 ' CB ' ' HG2' ' A' ' 39' ' ' ARG . 8.6 p-10 -73.83 115.66 13.53 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.324 1.449 . . . . 0.0 111.09 162.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.64 -22.11 38.42 Favored Glycine 0 CA--C 1.543 1.789 0 C-N-CA 125.629 1.585 . . . . 0.0 112.251 -166.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.02 -45.49 49.42 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.723 1.609 . . . . 0.0 110.591 178.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.689 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -163.38 -177.56 5.38 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.28 1.432 . . . . 0.0 111.657 173.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.979 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -124.74 171.0 14.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 126.122 1.769 . . . . 0.0 109.767 162.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.412 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 14.9 p90 -137.8 148.48 45.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.835 1.254 . . . . 0.0 111.105 169.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.912 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -131.11 107.84 9.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.896 1.678 . . . . 0.0 111.637 -162.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.941 HG22 HG23 ' A' ' 52' ' ' VAL . 69.1 t -92.84 96.29 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.463 1.505 . . . . 0.0 110.139 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.45 -29.16 2.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.835 1.654 . . . . 0.0 111.301 -170.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.816 HG22 HG12 ' A' ' 31' ' ' VAL . 3.3 t -74.86 -34.33 62.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.575 1.55 . . . . 0.0 110.819 -164.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.644 HG23 ' HB ' ' A' ' 36' ' ' ILE . 8.8 t -100.15 -5.82 27.18 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.557 1.543 . . . . 0.0 111.25 167.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 44.05 34.02 2.96 Favored Glycine 0 N--CA 1.494 2.565 0 C-N-CA 126.154 1.835 . . . . 0.0 108.821 -174.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.644 ' HB ' HG23 ' A' ' 34' ' ' THR . 52.6 mt -94.23 158.09 2.96 Favored 'Isoleucine or valine' 0 C--N 1.362 1.112 0 C-N-CA 125.955 1.702 . . . . 0.0 109.77 167.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.921 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 41.6 p90 -127.86 160.05 33.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.437 1.495 . . . . 0.0 110.959 168.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 63.7 m -144.55 177.33 8.74 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 127.214 2.206 . . . . 0.0 110.499 -163.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.586 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 1.4 tpp180 -100.19 159.02 30.91 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 126.532 1.933 . . . . 0.0 109.575 160.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.86 ' HA ' HG22 ' A' ' 16' ' ' VAL . 12.8 Cg_endo -45.18 -26.13 2.2 Favored 'Trans proline' 0 CA--C 1.547 1.135 0 C-N-CA 124.403 3.402 . . . . 0.0 114.871 -177.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.437 ' HB2' ' HA ' ' A' ' 21' ' ' PRO . 8.4 t -90.58 19.48 5.32 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 126.195 1.798 . . . . 0.0 112.743 -160.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 9.0 t -64.68 91.14 0.08 Allowed 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.458 1.026 . . . . 0.0 110.753 -161.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.787 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -45.43 -45.92 13.15 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.03 1.732 . . . . 0.0 111.33 -166.185 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.787 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -50.37 138.1 17.54 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.434 1.494 . . . . 0.0 111.216 175.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -40.02 101.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.269 1.428 . . . . 0.0 110.822 166.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 158.69 23.02 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.367 1.067 . . . . 0.0 110.847 -162.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.605 ' CB ' HG11 ' A' ' 31' ' ' VAL . . . -75.03 126.37 30.88 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.328 1.451 . . . . 0.0 110.563 160.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.3 157.07 0.51 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.63 1.572 . . . . 0.0 111.307 -161.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.53 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.0 OUTLIER -33.87 -38.46 0.05 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.785 2.034 . . . . 0.0 111.8 163.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.48 -22.17 57.45 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 126.142 1.777 . . . . 0.0 112.17 -161.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -107.66 -7.35 16.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.621 1.968 . . . . 0.0 111.385 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.941 HG23 HG22 ' A' ' 31' ' ' VAL . 0.5 OUTLIER -106.58 135.86 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 125.807 1.643 . . . . 0.0 110.15 -167.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.4 p -140.11 157.53 45.48 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.625 1.57 . . . . 0.0 111.823 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.544 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 1.6 m-85 -113.93 138.8 49.84 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.587 1.555 . . . . 0.0 112.67 -160.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.979 ' HB2' HG22 ' A' ' 28' ' ' VAL . 2.0 m-85 -113.42 179.99 3.8 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 129.052 2.941 . . . . 0.0 111.357 171.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.3 -48.16 18.15 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.564 1.546 . . . . 0.0 111.618 162.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -147.37 178.7 8.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.206 1.402 . . . . 0.0 111.701 -175.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.921 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.16 -16.89 48.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.292 1.837 . . . . 0.0 111.724 -168.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 3.2 t -71.6 -32.46 68.03 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.893 1.677 . . . . 0.0 112.141 171.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.699 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -63.4 -44.85 93.49 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.962 1.705 . . . . 0.0 109.948 165.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 64' ' ' ALA . . . -67.91 -33.7 75.2 Favored 'General case' 0 C--N 1.356 0.88 0 C-N-CA 125.367 1.467 . . . . 0.0 110.888 177.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.453 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.2 mt -69.11 -36.95 78.08 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.416 1.886 . . . . 0.0 110.616 166.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -59.58 -21.16 59.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.999 1.72 . . . . 0.0 111.138 166.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.59 -17.76 40.54 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.389 1.476 . . . . 0.0 111.745 174.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 104.89 -13.17 49.77 Favored Glycine 0 CA--C 1.55 2.231 0 C-N-CA 124.352 0.977 . . . . 0.0 113.469 -175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.664 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 19.2 m-30 -79.7 157.82 27.11 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.036 1.734 . . . . 0.0 111.456 -160.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.17 158.05 32.55 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 126.411 1.884 . . . . 0.0 111.391 178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.489 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 6.3 Cg_exo -78.9 116.24 3.7 Favored 'Trans proline' 0 CA--C 1.546 1.077 1 C-N-CA 125.634 4.223 . . . . 0.0 115.246 -175.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 26.1 t -43.07 148.63 0.25 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.001 2.12 . . . . 0.0 110.998 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -86.57 15.61 5.41 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.698 1.599 . . . . 0.0 110.624 -172.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.98 -50.75 0.77 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.616 1.966 . . . . 0.0 111.1 -165.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.2 m -99.78 -51.31 3.76 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.733 1.613 . . . . 0.0 111.084 -174.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.555 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -81.22 172.06 10.68 Favored Pre-proline 0 CA--C 1.551 0.984 0 C-N-CA 125.355 1.462 . . . . 0.0 110.349 -164.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -55.12 82.12 0.03 OUTLIER 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 124.357 3.372 . . . . 0.0 112.951 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -162.34 -70.57 0.05 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.943 1.697 . . . . 0.0 111.092 -168.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -100.96 85.69 2.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.802 1.241 . . . . 0.0 110.236 163.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.734 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -51.68 175.92 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.947 1.699 . . . . 0.0 111.429 166.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -89.14 79.19 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.997 1.719 . . . . 0.0 111.073 171.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.734 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 69.0 Cg_endo -79.87 7.06 4.82 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.473 3.449 . . . . 0.0 113.068 -168.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 ttp180 -24.02 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.863 2.465 . . . . 0.0 112.814 -161.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -25.56 -87.3 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 127.022 2.129 . . . . 0.0 111.658 167.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -148.6 -57.11 0.22 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 126.235 1.814 . . . . 0.0 110.95 160.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 32.26 86.75 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 126.565 1.946 . . . . 0.0 111.075 -172.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 mt 179.69 92.08 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.472 1.909 . . . . 0.0 112.142 -166.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -125.4 -68.71 0.82 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.886 2.075 . . . . 0.0 111.117 172.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -30.58 124.47 0.19 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.532 1.933 . . . . 0.0 110.873 167.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.75 155.14 41.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.806 1.642 . . . . 0.0 108.989 165.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 7.3 m -46.9 -51.49 16.66 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.585 1.554 . . . . 0.0 110.077 -171.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 90' ' ' ALA . 20.6 t60 -96.62 -71.42 0.68 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.571 1.548 . . . . 0.0 111.408 172.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 89' ' ' HIS . . . 166.34 -41.92 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.581 1.552 . . . . 0.0 110.706 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -123.19 -174.91 3.06 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.607 1.563 . . . . 0.0 110.385 -174.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 125.639 1.575 . . . . 0.0 110.193 -177.789 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -71.84 -27.52 62.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.571 1.548 . . . . 0.0 110.52 177.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.408 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.1 OUTLIER -110.1 -178.32 3.49 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.603 1.561 . . . . 0.0 110.522 170.844 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 3' ' ' LYS . . . 71.27 97.16 0.07 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.57 1.548 . . . . 0.0 111.29 -172.699 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.863 HG23 HD23 ' A' ' 7' ' ' LEU . 1.0 OUTLIER 63.53 112.92 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.61 1.564 . . . . 0.0 110.05 -175.503 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 m -99.61 74.74 1.89 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.556 1.543 . . . . 0.0 110.393 175.212 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.863 HD23 HG23 ' A' ' 5' ' ' THR . 0.2 OUTLIER -89.73 19.79 4.49 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.394 1.878 . . . . 0.0 110.92 -172.49 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.3 p -48.52 152.43 0.93 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.291 1.836 . . . . 0.0 110.874 -175.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -60.55 -23.63 64.75 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.689 1.596 . . . . 0.0 111.377 173.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -40.22 -70.83 0.09 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.031 1.332 . . . . 0.0 111.002 162.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.009 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 2.2 tt0 -79.69 -20.91 45.43 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.297 1.039 . . . . 0.0 110.953 -167.446 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -43.08 -57.22 3.0 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-O 123.148 1.451 . . . . 0.0 109.817 160.07 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.773 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 18.8 t-105 -74.26 -20.01 60.3 Favored 'General case' 0 C--N 1.364 1.217 0 CA-C-N 114.338 -1.301 . . . . 0.0 112.171 176.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.009 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.4 -51.1 39.75 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 119.396 0.998 . . . . 0.0 110.366 174.532 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.7 t -65.91 -25.64 67.24 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.931 1.292 . . . . 0.0 112.835 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.981 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.7 t -89.63 -27.66 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 126.186 1.795 . . . . 0.0 110.48 -179.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.41 HD23 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -75.7 -41.33 53.97 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.205 1.402 . . . . 0.0 110.517 168.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.95 -8.51 16.01 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.333 1.853 . . . . 0.0 110.951 174.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.7 ptt180 52.95 22.49 2.44 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.534 1.534 . . . . 0.0 110.724 172.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -54.4 93.98 0.05 OUTLIER Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.066 1.746 . . . . 0.0 110.902 -177.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.446 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 37.2 Cg_exo -63.35 -11.69 26.89 Favored 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.531 3.487 . . . . 0.0 113.146 -165.683 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -94.02 15.98 15.64 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.472 1.909 . . . . 0.0 111.077 -170.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.572 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -110.45 26.17 10.98 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.593 1.557 . . . . 0.0 111.075 176.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 0.1 OUTLIER -71.92 4.17 3.63 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.705 1.602 . . . . 0.0 111.912 171.083 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.38 -33.73 1.72 Allowed Glycine 0 CA--C 1.543 1.828 0 C-N-CA 125.531 1.539 . . . . 0.0 111.879 171.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -70.58 -30.16 66.78 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.948 1.699 . . . . 0.0 110.855 -165.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.664 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 21.5 p90 -176.68 -178.26 0.87 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.318 1.447 . . . . 0.0 111.735 -177.779 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.93 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.3 m -135.09 167.2 26.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 126.186 1.794 . . . . 0.0 109.47 160.6 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.618 ' CD1' HG21 ' A' ' 52' ' ' VAL . 13.6 p90 -134.17 144.65 48.62 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.736 1.214 . . . . 0.0 111.126 176.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.702 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -128.61 105.35 8.22 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.298 1.839 . . . . 0.0 111.706 -161.101 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.7 ' CG2' ' HB3' ' A' ' 47' ' ' ALA . 52.9 t -85.43 111.44 20.82 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 125.494 1.518 . . . . 0.0 110.175 179.589 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.7 mmt85 -68.71 -13.57 62.47 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.874 1.67 . . . . 0.0 111.593 -167.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.602 HG22 ' CG1' ' A' ' 31' ' ' VAL . 13.8 t -96.63 -29.83 13.61 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.462 1.505 . . . . 0.0 110.791 -166.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.707 HG23 ' H ' ' A' ' 36' ' ' ILE . 14.9 t -101.68 -8.92 21.36 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.817 1.647 . . . . 0.0 111.239 167.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.88 34.85 5.79 Favored Glycine 0 N--CA 1.494 2.542 0 C-N-CA 126.295 1.902 . . . . 0.0 109.061 -174.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.707 ' H ' HG23 ' A' ' 34' ' ' THR . 65.5 mt -95.93 158.64 3.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 125.807 1.643 . . . . 0.0 109.91 167.409 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.931 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 46.8 p90 -134.3 148.19 50.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.643 1.577 . . . . 0.0 111.066 172.296 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 91.7 m -132.47 175.13 9.56 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 127.365 2.266 . . . . 0.0 111.195 -166.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.547 ' CG ' ' HD2' ' A' ' 40' ' ' PRO . 10.7 ttm180 -93.66 150.9 39.51 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.901 2.081 . . . . 0.0 109.403 158.309 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.981 ' HA ' HG22 ' A' ' 16' ' ' VAL . 10.3 Cg_endo -43.48 -23.71 0.53 Allowed 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.328 3.352 . . . . 0.0 115.163 -176.128 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.446 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.21 7.63 8.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.842 2.057 . . . . 0.0 112.92 -165.325 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -55.1 100.64 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 O-C-N 121.242 -0.911 . . . . 0.0 110.331 -161.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.821 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -67.7 -51.53 48.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.955 1.702 . . . . 0.0 111.334 -161.576 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.821 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -61.66 132.48 53.38 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.416 1.487 . . . . 0.0 111.056 170.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -42.06 122.7 2.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.704 1.601 . . . . 0.0 110.946 -174.549 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -99.93 148.56 24.35 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.039 1.336 . . . . 0.0 111.24 -163.234 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.7 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.05 139.8 4.22 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.55 1.54 . . . . 0.0 111.129 163.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 4.8 mt -59.9 158.97 9.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.54 1.536 . . . . 0.0 110.911 -164.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -36.69 -50.89 0.85 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.255 1.822 . . . . 0.0 110.996 163.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -71.46 -18.81 62.29 Favored 'General case' 0 C--N 1.355 0.843 0 C-N-CA 126.144 1.778 . . . . 0.0 111.916 -164.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -101.34 -20.51 15.17 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.424 1.89 . . . . 0.0 111.065 178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.641 HG23 ' CG2' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -97.7 144.84 10.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 C-N-CA 125.836 1.655 . . . . 0.0 110.274 -176.146 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.0 p -138.87 155.97 47.67 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.723 1.609 . . . . 0.0 111.791 172.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 68.3 m-85 -111.04 134.68 52.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.882 1.673 . . . . 0.0 112.608 -160.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.93 ' HB2' HG22 ' A' ' 28' ' ' VAL . 9.0 m-30 -116.68 -177.47 3.2 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 128.698 2.799 . . . . 0.0 112.203 176.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.11 -41.22 25.93 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 126.355 1.862 . . . . 0.0 110.898 170.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HA ' HG13 ' A' ' 28' ' ' VAL . 24.2 p30 -168.56 177.79 5.06 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.568 1.947 . . . . 0.0 111.087 -174.085 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.931 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -82.02 -8.11 59.65 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.354 1.462 . . . . 0.0 112.092 -166.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.455 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 0.2 OUTLIER -67.57 -36.25 80.56 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.559 1.544 . . . . 0.0 111.493 164.662 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.453 ' HG3' ' CD2' ' A' ' 55' ' ' TYR . 9.7 tp10 -66.27 -41.03 90.47 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.478 1.911 . . . . 0.0 110.158 169.095 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.833 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -69.71 -30.09 67.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.574 1.95 . . . . 0.0 111.068 174.167 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.455 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.5 mt -72.4 -38.75 68.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.226 1.81 . . . . 0.0 110.591 168.128 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.16 -27.72 69.15 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.256 1.822 . . . . 0.0 111.533 173.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.28 58.09 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.349 1.46 . . . . 0.0 111.542 173.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 78.15 39.65 22.67 Favored Glycine 0 CA--C 1.543 1.806 0 C-N-CA 125.771 1.653 . . . . 0.0 112.016 179.36 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.702 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 10.3 m-30 -103.38 159.77 15.28 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.692 1.597 . . . . 0.0 110.898 -176.557 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.644 ' HD3' ' HD2' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -95.76 146.44 31.33 Favored Pre-proline 0 CA--C 1.551 0.989 0 C-N-CA 125.676 1.59 . . . . 0.0 111.347 175.196 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.644 ' HD2' ' HD3' ' A' ' 67' ' ' ARG . 56.7 Cg_endo -62.54 116.74 3.71 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 124.84 3.693 . . . . 0.0 115.052 170.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.463 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 19.4 t -41.37 151.17 0.08 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.607 1.963 . . . . 0.0 110.836 175.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 16.86 3.79 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.577 1.551 . . . . 0.0 110.553 -177.089 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' HD3' ' CB ' ' A' ' 44' ' ' ALA . 0.1 OUTLIER -137.12 -48.69 0.6 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.615 1.966 . . . . 0.0 111.044 -167.809 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 4.1 m -100.65 -74.48 0.61 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.493 1.517 . . . . 0.0 111.145 -179.22 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.576 ' CG ' ' CE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -79.43 136.65 56.1 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.247 1.419 . . . . 0.0 110.506 -161.178 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -32.51 87.56 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.095 1 C-N-CA 126.41 4.74 . . . . 0.0 114.477 -164.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -153.9 -69.13 0.14 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.22 1.808 . . . . 0.0 111.115 -175.241 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.29 24.19 12.84 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.294 1.437 . . . . 0.0 110.462 164.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -90.41 124.01 34.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.502 1.521 . . . . 0.0 111.337 165.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 62.85 72.7 0.57 Allowed Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.511 1.524 . . . . 0.0 110.995 172.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.42 -31.68 48.99 Favored 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 124.309 3.339 . . . . 0.0 112.613 -177.377 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.429 ' CG ' ' N ' ' A' ' 81' ' ' GLN . 0.1 OUTLIER -15.85 -100.76 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 128.4 2.68 . . . . 0.0 113.031 -163.448 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' N ' ' CG ' ' A' ' 80' ' ' ARG . 0.1 OUTLIER 31.62 76.64 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.964 2.106 . . . . 0.0 111.553 -175.572 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 63.06 151.92 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.312 1.445 . . . . 0.0 111.402 -174.686 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -112.11 58.07 0.64 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.828 1.251 . . . . 0.0 110.43 160.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.582 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.0 OUTLIER -38.62 133.4 1.05 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.132 2.173 . . . . 0.0 111.488 -178.26 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.582 ' N ' HD22 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -101.56 150.99 22.51 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.321 1.448 . . . . 0.0 111.236 174.864 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 tptt 63.27 117.82 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.818 1.647 . . . . 0.0 110.538 -170.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 87' ' ' ILE . 3.9 tp 178.14 98.32 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 125.627 1.571 . . . . 0.0 108.927 169.048 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 4.7 t -84.48 -38.26 20.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.59 1.556 . . . . 0.0 110.049 -173.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.28 149.04 30.5 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.613 1.565 . . . . 0.0 111.419 -170.396 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -113.12 -75.83 0.6 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.582 1.553 . . . . 0.0 110.732 -171.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.32 -35.71 12.28 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.619 1.568 . . . . 0.0 110.357 -171.286 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 . . . . . 0 N--CA 1.47 0.551 0 C-N-CA 125.59 1.556 . . . . 0.0 110.145 -179.076 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mtt . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 110.671 -0.122 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -160.47 130.35 5.18 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.575 1.55 . . . . 0.0 110.51 -177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.8 tttt 72.32 42.67 0.54 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.615 1.566 . . . . 0.0 110.543 -177.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 173.63 134.62 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.604 1.562 . . . . 0.0 111.234 -171.462 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.5 p -67.01 171.98 4.95 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.559 1.543 . . . . 0.0 110.106 179.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 29.7 m -103.55 118.59 37.09 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.611 1.565 . . . . 0.0 110.362 -172.864 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -89.71 22.86 2.89 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.375 1.87 . . . . 0.0 110.841 178.112 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 p -48.96 172.24 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.388 1.875 . . . . 0.0 110.882 175.817 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.527 ' HB2' HH21 ' A' ' 49' ' ' ARG . 0.0 OUTLIER -76.0 -32.75 59.57 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.275 1.43 . . . . 0.0 111.073 -178.591 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -37.0 -69.86 0.11 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.452 1.501 . . . . 0.0 111.193 164.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.024 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.7 OUTLIER -80.13 -26.74 39.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.341 1.056 . . . . 0.0 110.68 -166.85 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 8.2 mtt180 -39.8 -60.47 0.99 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-O 123.032 1.396 . . . . 0.0 110.484 160.962 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.811 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 27.6 t-105 -73.97 -16.82 61.06 Favored 'General case' 0 C--N 1.361 1.084 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.242 175.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.024 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.73 -57.02 5.63 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.333 0.97 . . . . 0.0 110.301 173.593 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.772 ' N ' ' HG3' ' A' ' 14' ' ' GLN . 1.9 t -41.75 -46.21 3.76 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.994 1.317 . . . . 0.0 111.792 165.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 1.028 HG22 ' HB3' ' A' ' 40' ' ' PRO . 25.4 t -83.22 -27.68 7.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.935 1.294 . . . . 0.0 111.298 -173.528 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.499 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 12.2 mt -76.0 -36.86 59.02 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.911 1.284 . . . . 0.0 110.61 175.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.33 -4.67 8.45 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.523 1.929 . . . . 0.0 110.941 170.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 51.16 26.84 3.08 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.504 1.522 . . . . 0.0 110.254 176.446 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -57.84 98.37 0.15 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 126.642 1.977 . . . . 0.0 110.763 -173.466 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.433 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 23.2 Cg_exo -60.79 -15.1 35.73 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.899 3.066 . . . . 0.0 112.591 -176.736 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -79.11 -5.52 54.29 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.88 2.072 . . . . 0.0 111.732 -174.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB1' ' CE1' ' A' ' 27' ' ' PHE . . . -105.79 22.37 15.68 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.426 1.491 . . . . 0.0 111.052 177.006 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.924 ' HA ' ' HG2' ' A' ' 39' ' ' ARG . 4.6 p-10 -69.08 -3.9 15.06 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.428 1.491 . . . . 0.0 112.085 173.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -116.09 -30.86 2.01 Favored Glycine 0 CA--C 1.543 1.802 0 C-N-CA 125.591 1.567 . . . . 0.0 111.733 179.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HB3' ' CD1' ' A' ' 27' ' ' PHE . 6.6 tp10 -70.76 -30.26 66.71 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.979 1.712 . . . . 0.0 110.931 -169.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.557 ' CE1' ' HB1' ' A' ' 23' ' ' ALA . 0.3 OUTLIER -170.68 -178.61 2.65 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.055 1.342 . . . . 0.0 111.941 -179.307 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.003 HG22 ' HB2' ' A' ' 55' ' ' TYR . 2.1 m -123.42 172.73 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 126.552 1.941 . . . . 0.0 109.291 160.437 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.511 ' CD2' ' HA ' ' A' ' 40' ' ' PRO . 1.1 p90 -137.03 156.58 48.24 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.379 1.072 . . . . 0.0 111.403 169.307 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.028 ' HB2' ' HE1' ' A' ' 55' ' ' TYR . . . -137.27 115.87 12.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.414 1.886 . . . . 0.0 111.29 -163.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.497 HG12 HG22 ' A' ' 34' ' ' THR . 37.6 t -90.86 97.6 7.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.004 1.322 . . . . 0.0 109.986 176.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -50.29 -26.08 4.43 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.615 1.566 . . . . 0.0 111.308 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' CG1' ' A' ' 31' ' ' VAL . 0.6 OUTLIER -86.35 -26.72 24.69 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.654 1.581 . . . . 0.0 110.894 -164.448 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.499 HG23 ' H ' ' A' ' 36' ' ' ILE . 13.1 t -100.35 -24.38 14.53 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.688 1.595 . . . . 0.0 110.866 176.389 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 62.27 48.79 80.14 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 125.482 1.515 . . . . 0.0 111.611 -166.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.499 ' H ' HG23 ' A' ' 34' ' ' THR . 57.1 mt -122.11 163.19 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 126.059 1.743 . . . . 0.0 110.172 168.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.808 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.4 p90 -134.05 157.75 45.31 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.839 1.656 . . . . 0.0 111.127 163.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 92.1 m -138.58 174.2 10.78 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 127.657 2.383 . . . . 0.0 110.884 -169.399 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.924 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 1.2 ttp180 -92.26 136.58 25.54 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 126.464 1.906 . . . . 0.0 108.947 157.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 1.028 ' HB3' HG22 ' A' ' 16' ' ' VAL . 82.4 Cg_exo -45.75 -20.9 0.77 Allowed 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 124.561 3.508 . . . . 0.0 115.915 -164.027 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.433 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.7 OUTLIER -75.91 13.0 0.93 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.575 2.35 . . . . 0.0 113.147 -173.215 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.1 t -55.21 101.89 0.06 Allowed 'General case' 0 N--CA 1.476 0.869 0 O-C-N 121.141 -0.974 . . . . 0.0 110.543 -161.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.723 ' HG2' ' HD3' ' A' ' 71' ' ' ARG . 1.0 OUTLIER -56.28 -46.47 79.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.061 1.744 . . . . 0.0 111.229 -163.332 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -54.23 148.33 11.59 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.457 1.503 . . . . 0.0 111.235 173.557 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -50.83 87.04 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.486 1.514 . . . . 0.0 110.957 171.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -77.31 141.65 39.81 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.203 1.401 . . . . 0.0 111.286 -165.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.473 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -46.32 140.07 4.36 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.762 1.625 . . . . 0.0 111.346 176.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 9.3 mt -59.09 160.66 5.93 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.611 1.564 . . . . 0.0 110.812 -169.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.527 HH21 ' HB2' ' A' ' 9' ' ' ASP . 0.0 OUTLIER -50.95 -32.41 20.8 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.673 1.589 . . . . 0.0 111.13 177.146 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.13 -15.67 63.47 Favored 'General case' 0 C--N 1.352 0.71 0 C-N-CA 125.704 1.602 . . . . 0.0 111.848 -167.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -114.99 -14.58 11.84 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.362 1.865 . . . . 0.0 111.161 172.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.596 HG11 ' CE3' ' A' ' 13' ' ' TRP . 0.6 OUTLIER -88.48 137.17 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 C-N-CA 125.745 1.618 . . . . 0.0 110.432 -179.004 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.5 p -140.37 157.09 46.07 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.584 1.554 . . . . 0.0 111.775 168.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 24.5 m-85 -113.06 136.69 52.43 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.645 1.578 . . . . 0.0 112.4 -161.297 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.028 ' HE1' ' HB2' ' A' ' 30' ' ' ALA . 17.3 m-85 -110.34 -178.74 3.58 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.925 2.89 . . . . 0.0 111.78 172.303 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.27 -41.76 21.7 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 125.602 1.561 . . . . 0.0 111.474 163.026 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -158.7 179.55 9.0 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.198 1.399 . . . . 0.0 111.752 -175.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.808 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -78.55 -15.5 58.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.265 1.826 . . . . 0.0 111.706 -168.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.458 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 1.1 p -71.51 -38.16 71.15 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.676 1.591 . . . . 0.0 111.9 171.34 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.2 OUTLIER -65.98 -40.14 90.97 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.969 1.708 . . . . 0.0 110.143 168.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.627 ' HB1' ' CG ' ' A' ' 37' ' ' PHE . . . -68.26 -33.25 74.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.415 1.486 . . . . 0.0 110.908 174.038 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.458 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.2 mt -66.93 -38.44 86.17 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 126.133 1.773 . . . . 0.0 110.542 165.008 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.91 -22.63 66.89 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.34 1.856 . . . . 0.0 111.41 174.494 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -82.14 -17.09 47.57 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.552 1.541 . . . . 0.0 111.561 174.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.36 38.07 15.9 Favored Glycine 0 CA--C 1.544 1.852 0 C-N-CA 125.843 1.687 . . . . 0.0 112.125 -174.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.902 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 12.1 m-30 -109.98 162.73 14.25 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.515 1.526 . . . . 0.0 110.947 -176.359 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -116.82 155.25 49.31 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.696 1.598 . . . . 0.0 111.442 -174.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.474 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 85.8 Cg_endo -76.56 113.93 3.76 Favored 'Trans proline' 0 CA--C 1.545 1.052 0 C-N-CA 124.372 3.381 . . . . 0.0 115.492 -172.008 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.404 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 18.3 t -42.36 147.34 0.27 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.74 2.016 . . . . 0.0 110.892 174.796 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.441 ' HG2' ' HB2' ' A' ' 76' ' ' LYS . 8.5 tttt -87.12 20.69 2.61 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.922 1.689 . . . . 0.0 110.945 -173.169 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.723 ' HD3' ' HG2' ' A' ' 43' ' ' ARG . 3.5 ttm105 -131.91 -64.76 0.77 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.254 2.622 . . . . 0.0 110.025 -172.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.2 m -87.11 -70.81 0.59 Allowed 'General case' 0 C--N 1.366 1.314 0 C-N-CA 126.152 1.781 . . . . 0.0 111.018 -175.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.493 ' HG2' ' CE2' ' A' ' 37' ' ' PHE . 3.6 tp-100 -63.2 120.86 65.47 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 125.209 1.403 . . . . 0.0 110.3 -175.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -39.77 91.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 125.162 3.908 . . . . 0.0 113.828 -167.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 49.7 t0 -145.7 -71.88 0.25 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.028 1.731 . . . . 0.0 111.115 -168.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.526 ' HA ' ' HG3' ' A' ' 79' ' ' PRO . 0.8 OUTLIER -131.59 60.04 1.68 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.797 1.239 . . . . 0.0 110.303 163.853 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -89.44 74.46 7.75 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 125.803 1.641 . . . . 0.0 111.343 165.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 38.7 58.51 5.53 Favored Pre-proline 0 CA--C 1.549 0.941 0 C-N-CA 125.636 1.574 . . . . 0.0 111.058 -167.764 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.526 ' HG3' ' HA ' ' A' ' 76' ' ' LYS . 72.1 Cg_endo -70.66 -36.4 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.364 3.376 . . . . 0.0 112.663 175.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -21.46 -78.26 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.299 2.64 . . . . 0.0 112.847 -168.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 5.22 82.86 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.522 2.729 . . . . 0.0 112.58 -168.969 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.7 146.91 5.84 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.399 1.48 . . . . 0.0 111.543 177.091 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -96.19 78.54 3.12 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.772 1.629 . . . . 0.0 111.104 168.081 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.725 HD23 ' H ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER 179.51 160.9 0.8 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.512 1.925 . . . . 0.0 111.918 179.513 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.725 ' H ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -111.67 -71.6 0.75 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.592 1.557 . . . . 0.0 111.215 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -39.09 137.03 0.75 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.588 1.555 . . . . 0.0 110.489 172.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.478 HG23 ' O ' ' A' ' 87' ' ' ILE . 1.2 tt -170.35 95.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 125.593 1.557 . . . . 0.0 108.938 173.934 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.9 m -75.21 89.99 2.55 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.595 1.558 . . . . 0.0 110.056 171.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -78.16 -34.03 49.93 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.648 1.579 . . . . 0.0 111.428 -177.808 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -155.29 -69.48 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.578 1.551 . . . . 0.0 110.7 -179.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.1 p -167.13 -46.84 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.597 1.559 . . . . 0.0 110.362 -178.438 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.4 ttp180 . . . . . 0 N--CA 1.47 0.531 0 C-N-CA 125.649 1.58 . . . . 0.0 110.135 -176.237 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 mmt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -125.81 50.59 1.83 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.618 1.567 . . . . 0.0 110.538 172.684 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt 49.63 40.41 19.62 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.609 1.564 . . . . 0.0 110.52 -176.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.47 -151.87 0.23 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.538 1.535 . . . . 0.0 111.247 167.636 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -42.3 141.69 0.91 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.601 1.56 . . . . 0.0 110.011 177.43 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.832 ' HB2' HG23 ' A' ' 8' ' ' THR . 7.8 p -43.53 122.78 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.592 1.557 . . . . 0.0 110.436 173.89 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -89.72 23.28 2.73 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.377 1.871 . . . . 0.0 110.899 176.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.832 HG23 ' HB2' ' A' ' 6' ' ' CYS . 20.9 p -53.11 141.62 22.48 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.404 1.882 . . . . 0.0 110.827 174.544 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.7 ' HB3' ' NH1' ' A' ' 12' ' ' ARG . 1.2 p30 -61.36 -28.35 69.16 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.754 1.621 . . . . 0.0 111.447 176.039 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.406 ' HA ' ' NH2' ' A' ' 49' ' ' ARG . 0.6 OUTLIER -39.08 -72.17 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.967 1.307 . . . . 0.0 111.005 163.221 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.055 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.86 -28.08 33.18 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.443 1.097 . . . . 0.0 110.962 -166.518 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.7 ' NH1' ' HB3' ' A' ' 9' ' ' ASP . 43.9 mtp180 -39.84 -56.72 1.72 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.92 1.288 . . . . 0.0 110.896 160.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.809 ' CZ3' HG11 ' A' ' 52' ' ' VAL . 33.8 t-105 -77.52 -16.65 58.56 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 115.258 -0.883 . . . . 0.0 112.051 176.582 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.055 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -68.41 -54.85 14.38 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 118.976 0.807 . . . . 0.0 110.32 172.543 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -39.31 -54.69 1.82 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.086 1.354 . . . . 0.0 111.869 162.35 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.805 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 40.4 t -79.26 -24.19 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 124.859 1.264 . . . . 0.0 110.87 -169.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 13' ' ' TRP . 11.9 mt -77.59 -39.16 46.47 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.212 1.405 . . . . 0.0 110.713 172.03 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -20.67 49.18 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.038 1.735 . . . . 0.0 110.659 171.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.96 21.76 12.55 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.924 1.69 . . . . 0.0 110.79 -174.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -53.3 95.94 0.09 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 126.269 1.827 . . . . 0.0 110.787 -170.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.425 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 35.1 Cg_exo -61.68 -13.84 32.45 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 124.232 3.288 . . . . 0.0 112.924 -170.528 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -92.96 9.8 34.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.668 1.987 . . . . 0.0 111.593 -166.828 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.73 ' HB3' ' HG3' ' A' ' 40' ' ' PRO . . . -106.78 24.32 12.9 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.508 1.523 . . . . 0.0 111.064 173.854 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.699 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -73.3 119.01 16.95 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.544 1.538 . . . . 0.0 111.164 163.061 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.05 -35.61 4.92 Favored Glycine 0 CA--C 1.543 1.838 0 C-N-CA 125.61 1.576 . . . . 0.0 112.078 -166.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -71.34 -40.53 70.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.629 1.572 . . . . 0.0 110.523 -173.244 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.794 ' HE1' ' HG3' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -165.31 -176.78 4.19 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.293 1.437 . . . . 0.0 111.641 172.428 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.995 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.1 m -128.56 170.54 18.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 126.159 1.784 . . . . 0.0 109.373 160.588 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 5.7 p90 -135.42 152.46 51.42 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.849 1.26 . . . . 0.0 111.152 171.148 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 1.065 ' HB2' ' HE2' ' A' ' 55' ' ' TYR . . . -131.64 108.02 9.22 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.257 1.823 . . . . 0.0 111.566 -162.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.727 HG22 HG23 ' A' ' 52' ' ' VAL . 59.4 t -86.8 93.24 3.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 125.226 1.41 . . . . 0.0 109.996 173.608 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -55.8 -21.63 20.41 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.579 1.552 . . . . 0.0 111.324 -172.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -85.17 -21.97 28.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.537 1.535 . . . . 0.0 110.824 -164.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.469 ' CG2' ' HB ' ' A' ' 36' ' ' ILE . 10.0 t -100.78 -22.25 14.92 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.757 1.623 . . . . 0.0 110.894 168.706 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.51 49.04 62.64 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 125.531 1.539 . . . . 0.0 111.844 -165.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.469 ' HB ' ' CG2' ' A' ' 34' ' ' THR . 30.4 mt -124.57 153.97 31.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 126.162 1.785 . . . . 0.0 109.887 178.474 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.739 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 4.1 p90 -132.15 151.91 51.54 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.31 1.444 . . . . 0.0 111.222 167.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 29' ' ' PHE . 98.3 m -135.84 175.07 9.93 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.683 2.393 . . . . 0.0 110.931 -167.007 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 1.025 ' HG2' ' HD2' ' A' ' 40' ' ' PRO . 0.3 OUTLIER -94.96 146.61 31.65 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 127.242 2.217 . . . . 0.0 108.747 157.908 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 1.025 ' HD2' ' HG2' ' A' ' 39' ' ' ARG . 9.7 Cg_endo -40.36 -28.46 0.31 Allowed 'Trans proline' 0 CA--C 1.545 1.047 1 C-N-CA 125.357 4.038 . . . . 0.0 115.804 -169.588 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.425 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.3 OUTLIER -80.78 12.8 2.96 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.87 2.068 . . . . 0.0 112.913 -160.673 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.4 t -55.75 107.91 0.39 Allowed 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.123 -0.986 . . . . 0.0 110.621 -161.494 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.89 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -56.91 -54.1 50.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.86 1.664 . . . . 0.0 111.356 -162.099 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.89 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -72.05 157.47 37.73 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.362 1.465 . . . . 0.0 111.053 178.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -54.13 90.08 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.465 1.506 . . . . 0.0 110.996 -167.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.2 134.57 49.41 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.694 1.198 . . . . 0.0 111.09 -163.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.672 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -45.62 149.27 0.61 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.808 1.643 . . . . 0.0 111.202 -170.144 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.2 mt -49.94 148.45 3.22 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.308 1.443 . . . . 0.0 110.608 -167.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' NH2' ' HA ' ' A' ' 10' ' ' ASP . 1.4 tpp85 -31.14 -45.05 0.07 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.626 1.97 . . . . 0.0 110.897 163.523 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -80.74 -24.98 38.35 Favored 'General case' 0 C--N 1.356 0.888 0 C-N-CA 126.663 1.985 . . . . 0.0 112.021 -161.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -91.4 -14.94 29.74 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.993 1.717 . . . . 0.0 111.121 171.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.809 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 0.8 OUTLIER -102.74 132.22 49.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.566 1.547 . . . . 0.0 110.212 -171.711 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -140.58 157.13 45.92 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.755 1.622 . . . . 0.0 111.654 172.5 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 12' ' ' ARG . 2.0 m-85 -111.34 136.99 49.67 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.555 1.542 . . . . 0.0 112.62 -161.198 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.065 ' HE2' ' HB2' ' A' ' 30' ' ' ALA . 25.1 m-85 -110.14 -179.77 3.88 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 129.293 3.037 . . . . 0.0 111.292 171.667 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -78.28 -39.19 40.71 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.656 1.582 . . . . 0.0 111.41 164.444 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 59' ' ' SER . 10.6 p30 -160.42 178.35 9.66 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.608 1.563 . . . . 0.0 111.405 -174.138 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.739 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -80.53 -16.22 54.77 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.147 1.779 . . . . 0.0 111.477 -169.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.606 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.5 t -72.58 -37.56 68.13 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.102 1.761 . . . . 0.0 112.134 171.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.574 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -64.5 -42.54 95.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.686 1.595 . . . . 0.0 109.92 166.544 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.583 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -66.64 -32.76 74.29 Favored 'General case' 0 C--N 1.356 0.876 0 C-N-CA 125.054 1.342 . . . . 0.0 110.76 175.698 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 2.6 mt -70.08 -39.54 75.55 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.385 1.874 . . . . 0.0 110.666 168.408 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -58.1 -22.07 49.06 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.942 1.697 . . . . 0.0 111.058 169.709 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 61' ' ' ALA . . . -83.26 -17.05 43.98 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.398 1.479 . . . . 0.0 111.704 173.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 106.89 -14.11 41.25 Favored Glycine 0 CA--C 1.55 2.23 0 C-N-CA 124.44 1.019 . . . . 0.0 113.634 -178.267 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.754 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 16.5 m-30 -80.13 169.78 17.34 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.813 1.645 . . . . 0.0 111.523 -160.818 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.2 mtt-85 -124.85 139.96 34.63 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 126.44 1.896 . . . . 0.0 111.377 -164.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.456 ' CB ' ' HB3' ' A' ' 73' ' ' GLN . 60.7 Cg_endo -67.62 109.0 1.74 Allowed 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.285 3.323 . . . . 0.0 115.368 -171.384 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.451 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 16.3 t -40.56 150.07 0.07 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.218 2.207 . . . . 0.0 111.181 -178.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.402 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 4.0 ttpm? -84.73 14.43 4.73 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.087 1.755 . . . . 0.0 110.817 -173.298 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.0 tpp180 -136.81 -50.56 0.66 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.553 1.941 . . . . 0.0 111.091 -167.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 3.7 m -95.25 -74.46 0.55 Allowed 'General case' 0 C--N 1.352 0.692 0 C-N-CA 125.422 1.489 . . . . 0.0 111.01 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.686 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -70.68 133.89 86.44 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.055 1.342 . . . . 0.0 110.228 -168.187 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -40.27 91.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 125.085 3.856 . . . . 0.0 113.957 -163.515 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.402 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.5 t0 -149.19 -67.1 0.22 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.172 1.789 . . . . 0.0 111.176 -177.841 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -145.0 96.21 2.82 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.168 1.387 . . . . 0.0 110.505 169.353 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -62.68 174.48 1.01 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.566 1.546 . . . . 0.0 111.329 -175.481 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -35.94 149.44 0.13 Allowed Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.987 1.715 . . . . 0.0 111.133 171.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.688 ' HD3' ' NH1' ' A' ' 43' ' ' ARG . 87.3 Cg_exo -50.98 134.36 42.34 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.314 3.342 . . . . 0.0 112.606 177.489 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.33 -76.1 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.864 2.466 . . . . 0.0 112.486 169.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -16.09 84.26 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 128.63 2.772 . . . . 0.0 112.819 -168.122 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.23 -37.88 7.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.809 1.643 . . . . 0.0 111.225 163.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 26.96 59.42 0.08 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.25 1.82 . . . . 0.0 111.074 -160.983 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.847 HD22 ' N ' ' A' ' 85' ' ' ASP . 0.7 OUTLIER -37.02 127.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.954 2.102 . . . . 0.0 111.492 -178.517 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.847 ' N ' HD22 ' A' ' 84' ' ' LEU . 2.7 t0 -114.11 -83.22 0.61 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.224 1.41 . . . . 0.0 111.237 179.459 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 160.94 86.07 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.037 1.735 . . . . 0.0 110.36 -168.631 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 56.91 53.73 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 125.512 1.525 . . . . 0.0 108.963 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.2 m -61.34 -61.09 2.79 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.571 1.549 . . . . 0.0 110.096 174.133 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -115.69 153.5 31.23 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.609 1.563 . . . . 0.0 111.429 172.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.98 104.46 1.13 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.594 1.558 . . . . 0.0 110.698 175.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 1.6 t -102.77 -45.41 5.01 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.589 1.556 . . . . 0.0 110.317 -171.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 C-N-CA 125.595 1.558 . . . . 0.0 110.135 -177.132 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtm . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 110.718 -0.104 . . . . 0.0 110.718 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.3 mttt 169.99 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.636 1.574 . . . . 0.0 110.525 -177.348 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.95 88.62 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.62 1.568 . . . . 0.0 110.468 -174.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 52.21 -153.94 0.2 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.558 1.543 . . . . 0.0 111.288 179.503 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 50.83 -171.77 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 127.021 2.128 . . . . 0.0 110.221 177.52 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.3 m -140.62 102.74 4.38 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.602 1.561 . . . . 0.0 110.456 -171.202 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' OE1' ' A' ' 11' ' ' GLN . 1.2 mm? -89.68 22.82 2.89 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.348 1.859 . . . . 0.0 110.932 171.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -52.26 178.69 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.195 1.798 . . . . 0.0 110.814 173.664 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -26.09 42.9 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.398 1.079 . . . . 0.0 110.682 -172.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 67.8 m-20 -38.11 -66.32 0.27 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.693 1.597 . . . . 0.0 111.209 163.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.026 ' HA ' ' HB3' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -87.74 -22.35 24.63 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.674 1.59 . . . . 0.0 111.136 -166.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.479 ' HB3' ' CZ ' ' A' ' 54' ' ' PHE . 20.3 mtt180 -42.21 -59.75 1.69 Allowed 'General case' 0 CA--C 1.55 0.973 0 CA-C-O 123.657 1.694 . . . . 0.0 109.609 157.128 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.841 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 13.1 t-105 -82.93 -25.18 32.64 Favored 'General case' 0 C--N 1.364 1.236 0 CA-C-N 114.027 -1.442 . . . . 0.0 113.472 175.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 1.026 ' HB3' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -74.31 -47.95 31.45 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 120.904 1.684 . . . . 0.0 109.703 179.465 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.473 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.4 t -42.98 -60.29 1.68 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.213 1.005 . . . . 0.0 111.164 159.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.841 HG11 ' CZ3' ' A' ' 13' ' ' TRP . 10.5 t -66.69 -28.13 42.22 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 125.599 1.56 . . . . 0.0 111.339 -175.675 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' N ' ' O ' ' A' ' 13' ' ' TRP . 9.3 mt -77.46 -35.91 53.4 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.125 1.37 . . . . 0.0 110.304 176.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 15' ' ' SER . . . -56.98 -19.97 21.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.573 1.549 . . . . 0.0 110.326 168.296 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 70.54 38.45 1.31 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.198 1.399 . . . . 0.0 110.946 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.517 ' OD2' ' HB2' ' A' ' 23' ' ' ALA . 54.6 t0 -61.12 111.24 3.89 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.668 1.187 . . . . 0.0 110.465 -161.393 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.97 -64.36 0.13 Allowed 'Trans proline' 0 CA--C 1.555 1.538 0 C-N-CA 124.248 3.298 . . . . 0.0 112.45 179.491 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -79.53 12.17 2.66 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.202 2.201 . . . . 0.0 110.995 -169.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.586 ' HB3' ' CG ' ' A' ' 40' ' ' PRO . . . -85.83 7.37 24.19 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.324 1.45 . . . . 0.0 111.2 163.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HA ' ' CG ' ' A' ' 39' ' ' ARG . 9.8 p-10 -73.21 112.94 9.73 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.778 1.631 . . . . 0.0 111.205 165.177 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 112.32 -36.65 4.03 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.594 1.568 . . . . 0.0 111.993 -166.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -69.31 -38.84 78.43 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.532 1.533 . . . . 0.0 110.526 -176.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 40' ' ' PRO . 6.6 p90 -166.2 179.78 5.52 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.116 1.366 . . . . 0.0 111.779 174.106 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.004 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -125.37 168.76 17.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 126.293 1.837 . . . . 0.0 109.1 159.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HE2' ' O ' ' A' ' 39' ' ' ARG . 42.4 p90 -139.07 151.16 46.52 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.252 1.021 . . . . 0.0 111.218 172.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HB1' ' CE2' ' A' ' 66' ' ' PHE . . . -131.91 112.83 12.77 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 126.394 1.878 . . . . 0.0 111.303 -161.183 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.8 HG22 HG23 ' A' ' 52' ' ' VAL . 52.9 t -92.21 98.27 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 125.137 1.375 . . . . 0.0 110.068 175.046 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -60.92 -16.0 37.3 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.803 1.641 . . . . 0.0 111.454 -169.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.595 HG22 ' CG1' ' A' ' 31' ' ' VAL . 6.6 t -91.58 -19.25 22.94 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.486 1.514 . . . . 0.0 110.775 -167.575 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.592 HG23 ' N ' ' A' ' 36' ' ' ILE . 10.6 t -100.51 -24.65 14.42 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.677 1.591 . . . . 0.0 110.8 167.309 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 61.57 49.29 78.33 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.308 1.432 . . . . 0.0 111.478 -162.469 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.592 ' N ' HG23 ' A' ' 34' ' ' THR . 31.3 mt -116.81 157.67 17.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.23 1.812 . . . . 0.0 109.909 170.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.772 ' CE1' ' HB1' ' A' ' 58' ' ' ALA . 13.1 p90 -127.12 164.02 22.53 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.487 1.515 . . . . 0.0 110.712 162.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 57.8 m -145.15 177.33 8.87 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.997 2.119 . . . . 0.0 110.644 -161.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.678 ' HG3' ' HD2' ' A' ' 40' ' ' PRO . 0.9 OUTLIER -107.4 153.76 41.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 126.148 1.779 . . . . 0.0 109.495 159.827 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.678 ' HD2' ' HG3' ' A' ' 39' ' ' ARG . 9.8 Cg_endo -42.66 -23.67 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.085 0 C-N-CA 124.483 3.455 . . . . 0.0 114.996 179.392 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.6 t -83.87 13.92 4.46 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.73 2.012 . . . . 0.0 112.838 -168.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 12.2 t -63.86 98.47 0.2 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 119.479 1.036 . . . . 0.0 110.427 -163.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.881 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -65.16 -50.59 65.39 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.962 1.705 . . . . 0.0 111.316 -162.182 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.881 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -45.73 166.72 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.403 1.481 . . . . 0.0 111.1 171.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 9.5 mtm-85 -65.34 119.84 11.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.466 1.507 . . . . 0.0 110.921 166.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.45 170.47 10.88 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.409 1.483 . . . . 0.0 111.251 -170.024 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.567 ' HB3' ' CG2' ' A' ' 31' ' ' VAL . . . -83.29 134.78 34.92 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.41 1.484 . . . . 0.0 110.949 161.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.05 159.38 0.9 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.625 1.57 . . . . 0.0 110.793 -164.3 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.531 ' HB2' ' CD1' ' A' ' 13' ' ' TRP . 0.2 OUTLIER -44.96 -31.6 1.34 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.404 1.882 . . . . 0.0 111.479 170.726 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -78.17 -18.08 55.99 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 126.056 1.743 . . . . 0.0 112.116 -165.574 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -112.57 11.39 19.68 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.959 2.103 . . . . 0.0 111.225 174.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.8 HG23 HG22 ' A' ' 31' ' ' VAL . 1.2 t -124.17 133.04 70.39 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 126.319 1.847 . . . . 0.0 109.98 -166.009 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -139.5 155.65 47.41 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.265 1.426 . . . . 0.0 112.03 176.409 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.512 ' CD1' ' N ' ' A' ' 54' ' ' PHE . 0.2 OUTLIER -117.17 138.49 51.64 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.723 1.609 . . . . 0.0 112.247 -160.893 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.004 ' HB2' HG22 ' A' ' 28' ' ' VAL . 12.9 m-85 -117.32 -178.69 3.52 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 129.114 2.966 . . . . 0.0 111.921 177.602 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.15 -46.0 24.89 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.963 1.705 . . . . 0.0 111.761 165.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.794 ' HA ' HG13 ' A' ' 28' ' ' VAL . 50.0 p30 -157.97 179.69 8.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.788 1.235 . . . . 0.0 111.539 177.319 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -77.47 -6.0 51.94 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.031 1.732 . . . . 0.0 111.638 -170.277 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.454 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 16.1 m -74.2 -39.95 62.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.966 1.706 . . . . 0.0 111.772 168.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.664 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 2.0 tt0 -62.62 -41.0 98.74 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.356 1.862 . . . . 0.0 109.892 167.027 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.585 ' HB1' ' CD2' ' A' ' 37' ' ' PHE . . . -69.76 -34.67 74.11 Favored 'General case' 0 C--N 1.355 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 111.002 176.021 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.454 ' HB2' ' HA ' ' A' ' 59' ' ' SER . 3.0 mt -65.18 -37.92 88.87 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.283 1.833 . . . . 0.0 110.472 165.088 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.664 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -61.75 -23.62 66.28 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.359 1.864 . . . . 0.0 111.444 173.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.28 -18.66 52.25 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.405 1.482 . . . . 0.0 111.553 169.29 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.22 40.84 40.44 Favored Glycine 0 CA--C 1.544 1.867 0 C-N-CA 125.814 1.674 . . . . 0.0 112.151 -173.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.747 ' CE2' ' HB1' ' A' ' 30' ' ' ALA . 14.3 m-30 -95.52 172.21 8.21 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.07 1.748 . . . . 0.0 110.922 178.171 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -112.73 153.61 45.03 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 125.893 1.677 . . . . 0.0 111.398 176.595 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 3.7 Cg_exo -76.41 121.38 6.01 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 125.289 3.992 . . . . 0.0 115.017 -174.668 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.0 t -44.51 152.7 0.19 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.972 1.709 . . . . 0.0 110.737 -178.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.451 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 14.2 tptm -83.06 10.66 7.59 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.357 1.463 . . . . 0.0 110.744 -176.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -138.9 -49.77 0.52 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.278 1.831 . . . . 0.0 111.129 -162.001 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 34.4 m -93.81 -69.76 0.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.681 1.592 . . . . 0.0 111.032 -175.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.624 ' HG3' ' HE1' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -69.82 123.2 88.16 Favored Pre-proline 0 CA--C 1.552 1.046 0 C-N-CA 125.009 1.323 . . . . 0.0 110.105 -178.042 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.421 ' HD2' ' NE2' ' A' ' 73' ' ' GLN . 41.0 Cg_exo -38.17 90.04 0.01 OUTLIER 'Trans proline' 0 CA--C 1.546 1.116 0 C-N-CA 125.201 3.934 . . . . 0.0 114.174 -163.661 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.451 ' HB3' ' HA ' ' A' ' 70' ' ' LYS . 1.0 OUTLIER -136.28 -64.87 0.59 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.316 1.846 . . . . 0.0 111.052 -178.657 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.97 92.71 4.27 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.845 1.258 . . . . 0.0 110.184 162.612 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.725 ' C ' ' HD2' ' A' ' 79' ' ' PRO . . . -81.97 -179.69 7.49 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.227 1.811 . . . . 0.0 111.461 165.233 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.889 HD22 ' HD3' ' A' ' 79' ' ' PRO . 0.0 OUTLIER -23.7 -47.39 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 127.322 2.249 . . . . 0.0 112.184 171.007 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.889 ' HD3' HD22 ' A' ' 78' ' ' ASN . 86.7 Cg_exo -42.76 90.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 125.199 3.933 . . . . 0.0 112.74 176.504 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -20.47 -103.28 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 128.528 2.731 . . . . 0.0 113.366 -161.692 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.752 ' HG3' ' N ' ' A' ' 82' ' ' HIS . 0.0 OUTLIER 156.8 169.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 127.644 2.377 . . . . 0.0 111.823 -174.724 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.752 ' N ' ' HG3' ' A' ' 81' ' ' GLN . 0.3 OUTLIER -148.15 113.35 5.54 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.506 1.523 . . . . 0.0 111.278 162.43 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.78 112.43 1.83 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.575 1.55 . . . . 0.0 111.139 166.7 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.435 HD23 ' N ' ' A' ' 85' ' ' ASP . 2.9 tt 179.52 139.03 0.11 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.489 1.915 . . . . 0.0 111.934 -173.767 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -72.74 -70.99 0.32 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.674 1.59 . . . . 0.0 111.214 -165.637 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -40.51 100.66 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.127 1.771 . . . . 0.0 110.696 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -96.26 146.97 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 C-N-CA 125.712 1.605 . . . . 0.0 108.972 -170.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.1 p -72.8 -34.14 66.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.59 1.556 . . . . 0.0 110.07 -175.627 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 78.8 m-70 -94.22 70.1 3.78 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.601 1.56 . . . . 0.0 111.414 -177.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -57.36 -85.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.557 1.543 . . . . 0.0 110.716 -172.185 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.24 -25.98 29.02 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.585 1.554 . . . . 0.0 110.341 -172.9 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.549 0 C-N-CA 125.583 1.553 . . . . 0.0 110.181 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -125.55 -98.75 0.41 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.615 1.566 . . . . 0.0 110.517 -175.48 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -113.56 107.79 16.28 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.593 1.557 . . . . 0.0 110.506 -170.319 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.474 ' CB ' ' CD2' ' A' ' 7' ' ' LEU . . . -179.79 -78.46 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.883 1.673 . . . . 0.0 111.066 176.34 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.403 ' O ' ' CB ' ' A' ' 6' ' ' CYS . 18.3 p 52.54 110.69 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 127.414 2.286 . . . . 0.0 110.512 -170.785 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' THR . 29.0 t 95.99 64.57 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 128.379 2.672 . . . . 0.0 109.931 -164.459 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.474 ' CD2' ' CB ' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -89.85 14.67 11.43 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.459 1.904 . . . . 0.0 110.885 -174.091 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.45 154.39 6.39 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.783 1.233 . . . . 0.0 110.509 -163.584 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HA ' ' CG ' ' A' ' 12' ' ' ARG . 4.1 p30 -72.5 -20.42 61.37 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.026 1.73 . . . . 0.0 111.397 -163.735 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -42.33 -73.26 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.136 1.374 . . . . 0.0 111.039 161.426 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.784 ' HA ' ' HB2' ' A' ' 14' ' ' GLN . 0.0 OUTLIER -81.07 -17.35 50.41 Favored 'General case' 0 C--N 1.353 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 110.66 -168.434 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' A' ' 54' ' ' PHE . 1.0 OUTLIER -44.53 -58.07 3.22 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-O 123.102 1.429 . . . . 0.0 109.353 159.716 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.789 ' CZ3' HG11 ' A' ' 16' ' ' VAL . 35.2 t-105 -71.26 -19.76 62.32 Favored 'General case' 0 C--N 1.365 1.259 0 CA-C-N 113.451 -1.704 . . . . 0.0 111.537 177.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.784 ' HB2' ' HA ' ' A' ' 11' ' ' GLN . 8.8 tm0? -63.8 -57.95 8.33 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.839 0.455 . . . . 0.0 110.442 168.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.32 -25.44 64.18 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.673 1.189 . . . . 0.0 112.624 177.327 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.892 HG22 ' HA ' ' A' ' 40' ' ' PRO . 2.9 t -89.88 -30.61 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 126.436 1.894 . . . . 0.0 110.097 -177.531 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.8 mt -73.68 -38.87 64.78 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.744 1.618 . . . . 0.0 110.764 170.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -8.28 8.73 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.483 1.913 . . . . 0.0 110.94 171.59 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.47 24.29 12.95 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 125.765 1.626 . . . . 0.0 111.139 170.003 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.3 95.05 0.05 OUTLIER Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 125.903 1.681 . . . . 0.0 110.841 -172.31 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.454 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 25.7 Cg_exo -64.31 -12.54 33.41 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.396 3.398 . . . . 0.0 113.045 -166.181 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 17.42 18.93 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.561 1.944 . . . . 0.0 111.104 -169.177 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.787 ' HB3' ' HG2' ' A' ' 40' ' ' PRO . . . -105.35 19.71 20.12 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.541 1.537 . . . . 0.0 111.204 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.752 ' HA ' ' HG3' ' A' ' 39' ' ' ARG . 1.6 p-10 -66.8 -3.39 6.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.27 1.428 . . . . 0.0 112.217 178.196 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.71 -24.17 2.16 Favored Glycine 0 CA--C 1.544 1.845 0 C-N-CA 125.661 1.601 . . . . 0.0 112.185 176.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -67.22 -33.71 75.93 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.784 1.634 . . . . 0.0 110.582 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CE1' ' HD3' ' A' ' 40' ' ' PRO . 24.3 p90 -176.68 -178.54 0.9 Allowed 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.225 1.41 . . . . 0.0 111.642 177.095 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 1.017 HG22 ' HB2' ' A' ' 55' ' ' TYR . 3.5 m -131.24 168.15 24.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 126.196 1.798 . . . . 0.0 109.42 160.855 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.725 ' HD1' HG22 ' A' ' 52' ' ' VAL . 12.8 p90 -136.05 149.45 48.77 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.675 1.19 . . . . 0.0 111.052 176.258 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.895 ' HB1' ' HE2' ' A' ' 66' ' ' PHE . . . -133.07 108.62 8.97 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.016 1.727 . . . . 0.0 111.662 -161.057 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.843 HG22 HG23 ' A' ' 52' ' ' VAL . 62.1 t -84.45 103.45 11.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.401 1.481 . . . . 0.0 110.076 173.772 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -31.18 68.24 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.655 1.582 . . . . 0.0 111.315 -168.613 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.418 HG22 HG12 ' A' ' 31' ' ' VAL . 2.8 t -79.59 -29.79 41.33 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.53 1.532 . . . . 0.0 110.83 -164.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.579 HG23 HG13 ' A' ' 36' ' ' ILE . 7.5 t -100.07 -4.38 29.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.575 1.55 . . . . 0.0 111.271 164.191 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 45.07 33.86 3.97 Favored Glycine 0 N--CA 1.494 2.561 0 C-N-CA 126.26 1.886 . . . . 0.0 109.005 -176.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.579 HG13 HG23 ' A' ' 34' ' ' THR . 25.7 mt -88.65 154.49 3.19 Favored 'Isoleucine or valine' 0 C--N 1.361 1.094 0 C-N-CA 126.114 1.765 . . . . 0.0 109.832 168.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.745 ' CE2' ' HB1' ' A' ' 58' ' ' ALA . 40.5 p90 -128.01 161.61 28.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.169 1.388 . . . . 0.0 111.081 166.471 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 56.3 m -147.49 179.88 7.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.93 2.092 . . . . 0.0 110.873 -160.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.752 ' HG3' ' HA ' ' A' ' 24' ' ' ASP . 14.5 ttm180 -105.83 151.59 39.99 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 126.558 1.943 . . . . 0.0 109.201 159.832 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.892 ' HA ' HG22 ' A' ' 16' ' ' VAL . 3.8 Cg_endo -37.94 -26.96 0.09 OUTLIER 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.582 3.521 . . . . 0.0 115.349 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.454 ' CB ' ' HA ' ' A' ' 21' ' ' PRO . 0.0 OUTLIER -78.43 2.7 17.99 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.636 1.974 . . . . 0.0 112.778 -165.806 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.7 t -54.47 97.85 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.159 0.891 . . . . 0.0 110.36 -161.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.771 ' HG3' ' N ' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -63.99 -51.96 61.82 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.465 1.506 . . . . 0.0 111.405 -161.554 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.771 ' N ' ' HG3' ' A' ' 43' ' ' ARG . . . -49.78 154.93 0.93 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.375 1.47 . . . . 0.0 111.193 178.188 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 -45.87 117.28 1.44 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.447 1.499 . . . . 0.0 110.973 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.0 m170 -55.72 137.01 50.42 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.572 1.549 . . . . 0.0 111.481 -168.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.63 120.39 27.02 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.449 1.5 . . . . 0.0 110.996 161.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 6.1 mt -45.87 149.6 0.63 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.809 1.643 . . . . 0.0 110.982 -162.639 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -32.76 0.52 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.885 1.674 . . . . 0.0 111.235 165.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -72.49 -21.59 61.19 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 125.712 1.605 . . . . 0.0 111.782 -165.712 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -101.3 -21.9 14.75 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.868 2.067 . . . . 0.0 111.071 171.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.843 HG23 HG22 ' A' ' 31' ' ' VAL . 0.8 OUTLIER -94.03 133.81 33.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.075 1.75 . . . . 0.0 110.086 -168.244 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 p -138.67 154.92 48.64 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.242 1.417 . . . . 0.0 111.866 175.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' CE2' ' HB3' ' A' ' 12' ' ' ARG . 41.0 m-85 -111.93 139.91 47.03 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.618 1.567 . . . . 0.0 112.761 -160.317 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 1.017 ' HB2' HG22 ' A' ' 28' ' ' VAL . 31.8 m-85 -114.46 179.55 3.92 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 129.25 3.02 . . . . 0.0 111.655 172.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.7 -35.64 33.34 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.162 1.785 . . . . 0.0 111.51 168.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.497 ' HA ' HG13 ' A' ' 28' ' ' VAL . 15.8 p30 -160.87 -178.65 6.96 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.596 1.558 . . . . 0.0 111.282 -179.662 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.745 ' HB1' ' CE2' ' A' ' 37' ' ' PHE . . . -68.11 -48.24 65.98 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.349 1.46 . . . . 0.0 111.491 -172.878 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.524 ' HA ' HD12 ' A' ' 62' ' ' LEU . 24.3 t -60.78 -12.75 11.67 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.195 1.798 . . . . 0.0 111.329 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.551 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -75.62 -52.66 10.05 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.989 1.716 . . . . 0.0 110.384 166.699 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.855 ' HB2' ' CD2' ' A' ' 55' ' ' TYR . . . -63.48 -23.5 67.42 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.698 1.599 . . . . 0.0 110.929 173.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.524 HD12 ' HA ' ' A' ' 59' ' ' SER . 16.9 mt -66.52 -44.59 82.09 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 126.962 2.105 . . . . 0.0 110.324 167.077 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' A' ' 60' ' ' GLU . . . -62.13 -22.35 65.77 Favored 'General case' 0 C--N 1.354 0.789 0 C-N-CA 126.552 1.941 . . . . 0.0 111.666 172.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -79.65 -15.81 56.91 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.414 1.485 . . . . 0.0 111.292 171.124 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.0 42.33 11.1 Favored Glycine 0 CA--C 1.543 1.825 0 C-N-CA 125.834 1.683 . . . . 0.0 112.084 -179.354 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.895 ' HE2' ' HB1' ' A' ' 30' ' ' ALA . 14.2 m-30 -106.68 166.8 10.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.646 1.578 . . . . 0.0 110.931 -177.576 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.473 ' H ' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -112.7 152.49 44.79 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 125.675 1.59 . . . . 0.0 111.415 177.955 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.509 ' HB3' ' HB3' ' A' ' 73' ' ' GLN . 6.1 Cg_exo -78.76 116.78 3.82 Favored 'Trans proline' 0 CA--C 1.546 1.086 1 C-N-CA 125.45 4.1 . . . . 0.0 115.128 -173.686 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' CG2' ' A' ' 36' ' ' ILE . 24.6 t -44.6 147.75 0.57 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.935 2.094 . . . . 0.0 110.58 -175.728 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 10.32 3.95 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.917 1.687 . . . . 0.0 111.336 -173.253 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.7 ttm105 -139.6 -48.52 0.47 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.22 2.208 . . . . 0.0 110.938 -166.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 69' ' ' CYS . 67.5 m -82.18 -74.67 0.33 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 127.409 2.283 . . . . 0.0 110.963 -177.293 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.509 ' HB3' ' HB3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.95 113.47 33.19 Favored Pre-proline 0 CA--C 1.552 1.029 0 C-N-CA 126.293 1.837 . . . . 0.0 110.093 -170.913 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -28.43 84.36 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.177 1 C-N-CA 126.375 4.717 . . . . 0.0 114.829 -163.101 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -130.63 -61.84 0.94 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.8 2.04 . . . . 0.0 110.878 -175.257 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.05 59.57 0.63 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.007 1.323 . . . . 0.0 109.911 160.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.641 ' O ' ' HD3' ' A' ' 79' ' ' PRO . . . -90.04 99.61 12.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.88 1.672 . . . . 0.0 111.295 165.599 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -70.05 93.35 0.04 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.658 1.583 . . . . 0.0 110.997 -170.055 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.641 ' HD3' ' O ' ' A' ' 77' ' ' ALA . 89.8 Cg_endo -71.94 -63.54 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 124.344 3.363 . . . . 0.0 112.688 -166.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.422 ' HG2' ' N ' ' A' ' 81' ' ' GLN . 35.6 ttt180 16.06 -116.46 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 127.555 2.342 . . . . 0.0 111.924 -163.373 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.422 ' N ' ' HG2' ' A' ' 80' ' ' ARG . 6.9 mm100 27.13 -91.34 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 127.195 2.198 . . . . 0.0 111.746 -173.633 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 170.75 154.08 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.224 1.81 . . . . 0.0 111.32 -177.951 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.9 ptt-85 -110.21 106.56 16.04 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.471 1.508 . . . . 0.0 111.117 166.132 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.501 ' HA ' HD22 ' A' ' 84' ' ' LEU . 0.2 OUTLIER 179.58 113.32 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.509 1.923 . . . . 0.0 112.021 -172.497 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -41.22 -57.73 2.02 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.016 1.726 . . . . 0.0 111.325 -177.168 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.456 ' HD2' HD12 ' A' ' 87' ' ' ILE . 3.8 mmtt 50.99 -169.34 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 125.593 1.557 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.456 HD12 ' HD2' ' A' ' 86' ' ' LYS . 1.8 mp -94.13 151.28 3.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 125.65 1.58 . . . . 0.0 108.968 -177.599 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -82.35 135.84 35.11 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.631 1.573 . . . . 0.0 110.034 178.676 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -139.24 -45.68 0.46 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.584 1.554 . . . . 0.0 111.418 -174.866 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -46.72 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.557 1.543 . . . . 0.0 110.772 -169.232 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.2 -164.9 0.23 Allowed 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.527 1.531 . . . . 0.0 110.376 169.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 45.1 ttt85 . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 125.615 1.566 . . . . 0.0 110.151 178.554 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_