data_2kz6_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 2kz6 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.481 HD11 ' HB2' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.509 HG21 ' HB3' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.449 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.492 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.47 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.483 ' HE2' HG12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.449 HD11 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.535 HD22 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.547 HG23 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.449 ' HA ' HD11 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.535 ' HG3' HD22 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.491 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.537 HD12 ' HB1' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.511 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.511 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.495 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.422 HE22 ' HB3' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.423 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.441 ' OE1' HD23 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.514 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.422 ' HB3' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.403 ' HB3' HD23 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.55 HD21 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp . . . . . 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.418 HD11 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.55 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.497 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.458 HG21 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.431 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.453 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.453 ' HG2' HD12 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.453 HD12 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.416 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.498 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.41 ' O ' HG11 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.514 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.465 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.41 HG11 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.498 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.413 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE3' HD23 ' A' ' 3' ' ' LEU . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.572 HD22 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.572 ' HG3' HD22 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.442 ' HB3' HG22 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.515 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.517 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.422 ' O ' HD12 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.559 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.424 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.562 ' HA ' HG13 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.516 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.559 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.428 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.418 HD11 ' O ' ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.425 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.428 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.592 HG22 ' HB1' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB1' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.491 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.549 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.549 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.442 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.542 ' HA ' HG12 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.416 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.542 HG12 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.496 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.454 HG12 HD21 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.496 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.482 HD11 HG22 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.592 HG22 ' HB3' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.482 HG22 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.474 ' HA ' HD13 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.575 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.423 ' O ' HG21 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.428 HG11 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.56 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.485 ' HG3' HD23 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.491 HD11 HD21 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.527 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . 0.575 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.531 HD23 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.49 HG22 ' HB3' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.439 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.439 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.49 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD23 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.487 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HB3' HG22 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.707 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD22 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.63 ' HA ' HG13 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.593 HE21 HG21 ' A' ' 58' ' ' THR . 23.7 mm-40 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.63 HG13 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.455 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.433 ' CG ' HG23 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.707 ' HH ' ' HB2' ' A' ' 51' ' ' ARG . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.435 HD12 ' HG3' ' A' ' 51' ' ' ARG . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 . . . . . 0 C--O 1.241 0.648 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.633 HG22 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.41 HG21 ' HB3' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.41 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.473 ' HZ1' ' HB3' ' A' ' 37' ' ' LYS . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.439 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HA ' HD12 ' A' ' 93' ' ' ILE . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.598 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.656 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.544 ' HA ' HG12 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.468 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.544 HG12 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.524 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.406 ' HH ' HH21 ' A' ' 51' ' ' ARG . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.538 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.504 HD13 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.504 ' CZ2' HD13 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.465 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB2' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.548 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.469 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.6 HH21 HD11 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.6 HD11 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.467 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.548 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.478 HG21 ' HB3' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.464 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.464 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.478 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.498 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.451 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.451 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.445 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.445 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.54 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.515 ' HA ' HG13 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.515 HG13 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.54 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.489 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.714 0.292 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.478 HD21 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.435 ' HE3' HD12 ' A' ' 3' ' ' LEU . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.435 HD12 ' HE3' ' A' ' 1' ' ' MET . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.515 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.515 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 48' ' ' ARG . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.554 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.554 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG13 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.541 HG13 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.463 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.502 ' HZ3' ' HB3' ' A' ' 75' ' ' LYS . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.047 0.451 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.526 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.461 ' HE3' HD22 ' A' ' 3' ' ' LEU . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.461 HD22 ' HE3' ' A' ' 1' ' ' MET . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.539 HG22 ' HB3' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.524 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.524 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD13 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.527 ' HG3' HD12 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.497 ' HA ' HG13 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.497 HG13 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.401 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.496 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.528 ' HA ' HD13 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 77' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp . . . . . 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.445 ' HB2' HD21 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.485 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.527 HG23 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.51 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.527 ' HB2' HG23 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.474 HD13 ' HB1' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.485 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.435 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.593 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG13 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.484 HG13 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.593 ' HH ' ' HB2' ' A' ' 51' ' ' ARG . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.505 HD11 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp . . . . . 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.46 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.494 HD13 ' HB1' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.468 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.487 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.568 ' HA ' HG12 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.409 ' CD2' HG22 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.487 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 121.01 0.433 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.429 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.437 ' HE2' ' HB ' ' A' ' 39' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 32' ' ' ILE . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.491 ' HB1' HD13 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.522 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.437 ' HB ' ' HE2' ' A' ' 1' ' ' MET . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.561 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.426 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.503 ' HA ' HG13 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.408 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.408 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.426 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.561 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 44' ' ' LEU . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.504 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.542 HG22 ' HB1' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.542 ' HB1' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.504 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HB3' HG22 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.412 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.481 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.402 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.402 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.464 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 121.627 0.727 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.505 HG22 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.537 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HG22 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.53 ' HB2' HD13 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.53 HD13 ' HB2' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.604 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.604 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.424 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.513 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.446 ' HG3' HD13 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.44 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.54 HG23 HD11 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.54 HD11 HG23 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.44 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.458 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.401 HG23 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.401 ' CD2' HG23 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.423 HD22 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.4 HG22 HD13 ' A' ' 44' ' ' LEU . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.436 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.436 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.495 HG21 HD11 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.412 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.55 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.511 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.528 HG22 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.528 HE21 HG22 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.477 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.511 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.427 ' HB3' HD23 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 120.962 0.41 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.55 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.406 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.554 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB3' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.431 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.524 ' HA ' HD23 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.459 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.414 ' O ' HD11 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.543 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.545 ' HA ' HG12 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.543 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' A' ' 93' ' ' ILE . 64.8 tp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 121.261 0.553 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.509 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TRP . . . . . 0.518 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.518 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.481 HD11 ' HB2' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.509 HG21 ' HB3' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.449 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.492 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.492 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.36 124.43 89.84 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.96 121.03 6.8 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.867 2.378 . . . . 0.0 111.773 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.03 95.77 0.06 Allowed 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.5 p -62.02 110.62 1.63 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.829 -168.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.22 129.31 37.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.0 m 57.01 80.74 0.15 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.529 ' HB2' ' HA ' ' A' ' 41' ' ' LEU . 1.5 m-20 -73.96 86.53 1.8 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.261 -164.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.1 mt -121.67 35.33 4.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.832 0.853 . . . . 0.0 109.632 -178.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.3 p -141.62 132.46 25.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.798 0.839 . . . . 0.0 109.261 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.5 107.38 0.57 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.707 0.803 . . . . 0.0 110.082 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.47 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.483 ' HE2' HG12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.449 HD11 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.535 HD22 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.547 HG23 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.449 ' HA ' HD11 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.535 ' HG3' HD22 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.491 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.547 ' HB2' HG23 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.537 HD12 ' HB1' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.511 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.511 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.495 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.422 HE22 ' HB3' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.514 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.423 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.441 ' OE1' HD23 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.514 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.467 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.422 ' HB3' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.467 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.403 ' HB3' HD23 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.55 HD21 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp -62.99 120.32 59.99 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 83' ' ' LEU . 18.2 Cg_endo -56.69 133.87 60.79 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.131 2.554 . . . . 0.0 112.463 176.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -171.35 2.29 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.26 0.624 . . . . 0.0 111.234 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.5 m -70.67 127.89 34.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.442 0.697 . . . . 0.0 112.474 -170.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 18.1 m -111.61 -164.51 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.337 1.055 . . . . 0.0 108.677 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 t -66.2 -31.14 71.8 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.408 0.549 . . . . 0.0 110.653 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -71.69 106.25 4.01 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.3 tp -72.69 94.3 1.73 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.21 -177.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.0 p -105.77 144.76 32.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.079 0.951 . . . . 0.0 109.418 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -74.78 140.77 44.24 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.418 HD11 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.55 ' HE3' HD21 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.497 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.458 HG21 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.458 ' HB2' HG21 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.431 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.497 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.453 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.453 ' HG2' HD12 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.513 ' HG2' ' HG2' ' A' ' 85' ' ' GLU . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.453 HD12 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.416 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.498 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.41 ' O ' HG11 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.514 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.465 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.41 HG11 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.44 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.498 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.413 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp -72.42 109.19 5.41 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.37 149.7 16.99 Favored 'Trans proline' 0 C--N 1.368 1.584 0 C-N-CA 122.099 1.866 . . . . 0.0 111.947 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.513 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -77.86 155.07 31.21 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.015 172.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.3 t -153.85 150.45 28.42 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.507 0.723 . . . . 0.0 109.989 177.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.483 HG23 HG21 ' A' ' 88' ' ' THR . 29.6 m -110.77 -28.91 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.656 0.782 . . . . 0.0 110.838 176.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.483 HG21 HG23 ' A' ' 87' ' ' VAL . 40.4 p -126.41 64.21 1.26 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.54 0.686 . . . . 0.0 110.459 -175.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.71 -83.36 0.05 Allowed 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 171.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.2 mt -131.09 112.37 12.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.6 m -86.57 61.35 6.77 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 121.94 0.876 . . . . 0.0 110.56 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -134.73 150.19 50.55 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.127 1.371 . . . . 0.0 108.008 170.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE3' HD23 ' A' ' 3' ' ' LEU . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.572 HD22 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.515 HG21 ' HB3' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.572 ' HG3' HD22 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.442 ' HB3' HG22 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.515 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.517 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 87' ' ' VAL . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.422 ' O ' HD12 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.559 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.424 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.562 ' HA ' HG13 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.505 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.516 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.559 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.428 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -76.92 109.9 10.3 Favored Pre-proline 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.96 -170.45 0.92 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 122.979 2.453 . . . . 0.0 112.359 -178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.07 163.78 29.53 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.176 0.513 . . . . 0.0 110.047 170.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.467 HG21 HD21 ' A' ' 90' ' ' LEU . 1.9 t -116.94 105.29 12.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.99 0.916 . . . . 0.0 108.827 178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.442 HG23 ' HG ' ' A' ' 41' ' ' LEU . 9.2 p -86.71 66.22 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-O 122.807 1.289 . . . . 0.0 110.22 -177.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.2 p -133.4 -166.07 1.72 Allowed 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.249 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.6 80.39 1.09 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.929 0.891 . . . . 0.0 110.494 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.467 HD21 HG21 ' A' ' 86' ' ' THR . 1.3 pt? 177.31 -172.49 0.1 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 125.02 1.328 . . . . 0.0 109.778 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 p -158.36 100.27 1.66 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.53 0.732 . . . . 0.0 109.772 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -142.4 101.89 3.98 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.418 HD11 ' O ' ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.425 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.428 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.592 HG22 ' HB1' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB1' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.491 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.495 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.549 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.549 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.442 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.542 ' HA ' HG12 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.416 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.542 HG12 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.609 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.609 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.605 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.496 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.91 145.75 96.93 Favored Pre-proline 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -59.51 139.79 90.95 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 122.249 1.966 . . . . 0.0 110.903 176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.15 111.27 0.73 Allowed 'General case' 0 C--N 1.355 0.835 0 O-C-N 124.097 0.873 . . . . 0.0 109.283 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.4 p -74.69 75.42 2.05 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.591 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.417 HG22 HG21 ' A' ' 88' ' ' THR . 31.3 m -86.08 -33.21 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 167.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.417 HG21 HG22 ' A' ' 87' ' ' VAL . 8.8 t -170.68 144.23 2.29 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 125.758 1.623 . . . . 0.0 107.64 174.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -165.63 162.71 19.07 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.7 mt -105.76 -0.73 25.14 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.171 0.588 . . . . 0.0 111.572 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 m -86.17 152.76 22.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.407 0.683 . . . . 0.0 110.453 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -69.94 123.82 22.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.454 HG12 HD21 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.496 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.423 ' O ' HG23 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.482 HD11 HG22 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.592 HG22 ' HB3' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.592 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.482 HG22 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.474 ' HA ' HD13 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.575 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.423 ' O ' HG21 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.428 HG11 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.56 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.485 ' HG3' HD23 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.41 108.96 9.86 Favored Pre-proline 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.95 151.3 78.05 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 122.75 2.3 . . . . 0.0 112.583 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.42 -57.89 5.17 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.639 0.733 . . . . 0.0 109.61 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 40.5 p -82.83 85.63 7.06 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 114.253 -1.34 . . . . 0.0 110.506 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.4 m -122.69 133.2 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.763 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.1 t -75.5 -12.57 60.26 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.07 0.548 . . . . 0.0 110.848 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -157.01 99.92 1.85 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.964 0.906 . . . . 0.0 109.431 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 tt -89.0 95.43 10.32 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 169.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.1 m -64.57 -70.66 0.21 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.324 0.65 . . . . 0.0 110.74 -174.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -137.43 157.0 47.53 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.055 0.942 . . . . 0.0 109.17 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.491 HD11 HD21 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.527 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . 0.575 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.531 HD23 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.49 HG22 ' HB3' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.439 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.439 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.49 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD23 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.477 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.487 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HB3' HG22 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.506 ' HD3' ' HG3' ' A' ' 85' ' ' GLU . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.707 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD22 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.63 ' HA ' HG13 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.593 HE21 HG21 ' A' ' 58' ' ' THR . 23.7 mm-40 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.63 HG13 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.455 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.433 ' CG ' HG23 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.455 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.707 ' HH ' ' HB2' ' A' ' 51' ' ' ARG . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD12 ' HG3' ' A' ' 51' ' ' ARG . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 89.8 mt -62.18 136.94 95.68 Favored Pre-proline 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 4.7 Cg_exo -75.69 58.38 5.3 Favored 'Trans proline' 0 C--N 1.384 2.426 0 C-N-CA 123.874 3.049 . . . . 0.0 112.138 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.506 ' HG3' ' HD3' ' A' ' 48' ' ' ARG . 7.9 mm-40 -90.78 9.4 30.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.592 1.157 . . . . 0.0 112.388 -172.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.3 p -60.83 -44.63 96.7 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.25 0.62 . . . . 0.0 109.873 167.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.6 t -104.83 10.97 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 C-N-CA 124.613 1.165 . . . . 0.0 109.732 177.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.435 ' HA ' ' HA ' ' A' ' 85' ' ' GLU . 41.2 p 45.77 80.99 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.212 1.405 . . . . 0.0 112.193 -171.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.16 -41.65 76.96 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.986 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.5 mp -79.05 88.43 4.8 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.872 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.1 p -78.93 -47.15 16.95 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 161.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -86.92 83.26 7.56 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.629 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.633 HG22 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.41 HG21 ' HB3' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.405 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.41 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.473 ' HB3' ' HZ1' ' A' ' 37' ' ' LYS . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.447 HG23 ' HA ' ' A' ' 90' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.5 ' HA ' HD12 ' A' ' 93' ' ' ILE . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.598 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.507 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.656 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.656 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.544 ' HA ' HG12 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.468 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.544 HG12 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.524 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.524 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' HH ' HH21 ' A' ' 51' ' ' ARG . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.538 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt -62.43 145.82 94.12 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -51.72 122.55 10.56 Favored 'Trans proline' 0 C--N 1.379 2.165 0 C-N-CA 123.636 2.89 . . . . 0.0 113.13 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -71.96 -28.91 63.74 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.937 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.3 m -72.47 85.46 1.13 Allowed 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 170.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.475 HG23 ' HB2' ' A' ' 44' ' ' LEU . 22.1 m -77.8 138.56 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.717 -174.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 41.2 p -77.03 157.43 31.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.326 0.651 . . . . 0.0 111.179 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -74.66 128.01 34.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.756 0.822 . . . . 0.0 110.854 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.447 ' HA ' HG23 ' A' ' 40' ' ' ILE . 3.0 mm? 52.28 69.85 0.63 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.002 1.321 . . . . 0.0 111.793 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 76.4 p -142.76 144.29 32.57 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.232 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -84.95 107.95 17.33 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 175.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.504 HD13 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.504 ' CZ2' HD13 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.465 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB2' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.548 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.469 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.6 HH21 HD11 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.6 HD11 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.467 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.51 137.52 97.11 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.46 150.77 86.52 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 122.997 2.465 . . . . 0.0 114.586 -167.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -81.45 -8.19 59.69 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.632 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.5 p -133.38 117.16 16.95 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.65 0.78 . . . . 0.0 109.616 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.4 p -80.97 146.79 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.118 0.567 . . . . 0.0 110.896 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.6 p -78.71 -164.13 0.55 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.05 0.94 . . . . 0.0 110.578 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -57.04 -40.2 76.32 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.121 0.968 . . . . 0.0 112.204 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.3 tp -156.42 110.15 2.71 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 124.014 0.925 . . . . 0.0 108.8 177.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -163.29 100.44 0.95 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.067 0.547 . . . . 0.0 109.709 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -73.83 121.19 20.49 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 169.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.548 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.527 HD12 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.478 HG21 ' HB3' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' HB3' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.464 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.478 ' HB3' HG21 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.498 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.484 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.451 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.451 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.445 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.445 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.54 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.515 ' HA ' HG13 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.515 HG13 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.54 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.489 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp -65.77 146.71 98.98 Favored Pre-proline 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -32.28 112.76 0.05 OUTLIER 'Trans proline' 0 C--N 1.394 2.969 1 C-N-CA 125.424 4.083 . . . . 0.0 115.293 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.34 130.55 44.25 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 124.041 0.838 . . . . 0.0 110.302 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.7 m 60.45 82.65 0.16 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 124.499 1.124 . . . . 0.0 109.079 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.41 HG12 HH11 ' A' ' 48' ' ' ARG . 25.9 m -60.67 142.93 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.039 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 28.6 p -65.21 102.7 0.68 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.691 0.796 . . . . 0.0 110.999 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -61.29 -25.77 67.33 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.146 0.979 . . . . 0.0 112.82 -174.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.559 ' H ' HD21 ' A' ' 90' ' ' LEU . 1.9 pt? -75.41 -14.86 60.48 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.383 0.673 . . . . 0.0 112.277 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.2 t -123.53 167.3 14.08 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.974 0.909 . . . . 0.0 109.488 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -90.66 -178.01 5.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.769 0.428 . . . . 0.0 110.939 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.478 HD21 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.435 ' HE3' HD12 ' A' ' 3' ' ' LEU . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.435 HD12 ' HE3' ' A' ' 1' ' ' MET . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.515 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.499 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.569 ' HG ' HG12 ' A' ' 87' ' ' VAL . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.574 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.57 ' HB2' HG23 ' A' ' 87' ' ' VAL . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.554 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.554 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG13 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.541 HG13 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.463 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.419 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.502 ' HB3' ' HZ3' ' A' ' 75' ' ' LYS . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.485 HD23 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp -72.44 132.88 83.41 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.86 129.5 22.24 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.912 2.408 . . . . 0.0 114.904 -161.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -68.41 85.74 0.28 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 160.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.428 ' H ' HG21 ' A' ' 93' ' ' ILE . 23.7 m -67.06 82.59 0.12 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.981 0.896 . . . . 0.0 111.415 -172.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG23 ' HB2' ' A' ' 45' ' ' ARG . 61.3 t -114.97 -20.6 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.879 176.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 24.6 m -48.08 -40.19 22.51 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 124.662 1.185 . . . . 0.0 110.757 170.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -138.85 150.45 46.02 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.896 171.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.439 HD21 ' HG3' ' A' ' 37' ' ' LYS . 23.6 tp -74.43 91.03 2.21 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.404 ' HB2' HG22 ' A' ' 86' ' ' THR . 72.9 m -147.08 159.5 43.52 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.264 1.026 . . . . 0.0 109.524 178.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -61.89 143.07 56.96 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.826 0.85 . . . . 0.0 112.06 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.428 HG21 ' H ' ' A' ' 86' ' ' THR . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.526 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.461 ' HE3' HD22 ' A' ' 3' ' ' LEU . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.461 HD22 ' HE3' ' A' ' 1' ' ' MET . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.539 HG22 ' HB3' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.524 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.539 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.524 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD13 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.527 ' HG3' HD12 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.497 ' HA ' HG13 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.497 HG13 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.496 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.528 ' HA ' HD13 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 77' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp -48.85 141.79 9.87 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.79 153.14 53.44 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 122.212 1.941 . . . . 0.0 111.685 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -61.82 91.75 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.432 1.093 . . . . 0.0 111.318 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.8 t -65.59 91.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.507 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.9 m -62.0 136.32 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.853 -173.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.275 6.7 t 57.66 -59.6 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 127.202 2.201 . . . . 0.0 114.674 -174.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.66 99.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.504 1.122 . . . . 0.0 111.532 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.8 tp -125.8 35.43 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 122.141 0.972 . . . . 0.0 109.789 -175.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 69.3 m -144.44 -50.6 0.28 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.756 0.822 . . . . 0.0 108.79 175.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 78.71 5.53 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 175.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.445 ' HB2' HD21 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.485 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.449 HD12 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.527 HG23 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.51 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.449 ' HG3' HD12 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.487 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.527 ' HB2' HG23 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.402 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.474 HD13 ' HB1' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.485 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.435 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.593 ' HB2' ' HH ' ' A' ' 76' ' ' TYR . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG13 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.484 HG13 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.593 ' HH ' ' HB2' ' A' ' 51' ' ' ARG . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.505 HD11 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.417 HD21 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp -70.51 124.98 91.84 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.11 130.87 18.34 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.662 2.242 . . . . 0.0 111.815 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.23 -49.65 73.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.567 1.147 . . . . 0.0 110.281 178.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.9 p -84.19 76.85 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.496 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -74.75 104.35 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 CA-C-O 121.923 0.868 . . . . 0.0 110.066 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 25.8 m -67.56 -38.3 83.91 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 110.934 -177.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -78.57 154.65 30.18 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.321 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.0 tp -81.14 82.26 7.11 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 175.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 m -137.27 145.38 43.44 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.061 0.944 . . . . 0.0 109.879 -174.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -83.61 152.04 25.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.692 0.797 . . . . 0.0 110.013 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.46 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.494 HD13 ' HB1' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.468 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.487 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.568 ' HA ' HG12 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.409 ' CD2' HG22 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.431 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.487 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.438 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.55 106.13 0.97 Allowed Pre-proline 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -88.1 61.64 3.26 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.723 2.949 . . . . 0.0 111.164 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -24.44 66.41 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.273 1.029 . . . . 0.0 112.394 177.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.1 t -96.23 13.38 27.65 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.905 0.882 . . . . 0.0 110.744 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.07 130.56 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.434 1.094 . . . . 0.0 108.302 173.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.8 p 52.81 30.77 9.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 125.706 1.602 . . . . 0.0 113.86 176.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -145.61 158.04 43.9 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.903 0.481 . . . . 0.0 111.116 -176.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.94 8.72 1.48 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.595 0.758 . . . . 0.0 111.351 -175.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 -68.68 0.53 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 -173.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -177.86 167.82 2.09 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.664 0.786 . . . . 0.0 111.478 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.429 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.437 ' HE2' ' HB ' ' A' ' 39' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 32' ' ' ILE . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.491 ' HB1' HD13 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.522 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.437 ' HB ' ' HE2' ' A' ' 1' ' ' MET . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.561 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.426 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.503 ' HA ' HG13 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.472 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.408 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.408 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.472 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.426 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.561 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt -63.66 132.93 95.35 Favored Pre-proline 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.24 158.0 50.89 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.02 2.48 . . . . 0.0 112.72 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.26 172.22 6.91 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.809 0.844 . . . . 0.0 110.88 -171.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.3 p 55.24 9.69 0.37 Allowed 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 125.593 1.557 . . . . 0.0 114.764 171.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.67 125.53 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.783 0.833 . . . . 0.0 109.966 -172.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.8 p -88.18 84.8 6.88 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.533 0.733 . . . . 0.0 110.228 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -68.6 -43.39 76.54 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.707 0.803 . . . . 0.0 110.489 -178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 53.95 36.82 25.3 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.466 1.506 . . . . 0.0 110.594 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.7 m -139.14 -63.44 0.52 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.603 0.761 . . . . 0.0 109.032 -176.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -172.52 111.13 0.24 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.77 0.828 . . . . 0.0 109.917 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.409 HD11 ' HA ' ' A' ' 44' ' ' LEU . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.504 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.542 HG22 ' HB1' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.542 ' HB1' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.481 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.504 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.481 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HB3' HG22 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.412 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.481 ' HA ' ' HB1' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.402 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.402 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.537 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.464 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.44 141.54 94.42 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -64.59 159.71 43.5 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 123.003 2.469 . . . . 0.0 112.918 177.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -100.96 8.07 43.25 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.06 0.544 . . . . 0.0 110.324 173.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.7 p -71.24 91.02 0.93 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.962 0.905 . . . . 0.0 110.874 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t 60.62 68.8 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.25 1.02 . . . . 0.0 110.272 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.7 m -149.4 98.27 2.76 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.643 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.26 -166.67 1.33 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.354 0.662 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.15 -30.77 70.59 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.084 0.953 . . . . 0.0 112.465 -175.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t -107.4 152.85 23.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.461 0.704 . . . . 0.0 109.297 176.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 59.75 81.36 0.17 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.946 1.299 . . . . 0.0 110.113 -175.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.505 HG22 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.537 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.494 HD13 HG22 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.53 ' HB2' HD13 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.53 HD13 ' HB2' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.604 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.513 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.43 115.48 18.48 Favored Pre-proline 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.78 86.1 1.62 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 C-N-CA 122.29 1.993 . . . . 0.0 110.274 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -64.02 -22.15 66.81 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.035 -1.439 . . . . 0.0 112.394 -171.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.0 p -78.06 98.4 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 109.504 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.2 t 60.51 84.7 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.228 1.411 . . . . 0.0 111.221 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.0 t -127.73 167.36 16.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.061 0.944 . . . . 0.0 109.862 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.83 -3.99 58.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.15 0.58 . . . . 0.0 111.042 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.58 104.37 3.85 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.7 t -70.89 -44.6 65.96 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -100.85 141.09 34.22 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.044 0.937 . . . . 0.0 109.671 176.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.604 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.424 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.513 ' HG3' ' HB2' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.446 ' HG3' HD13 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.44 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.54 HG23 HD11 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.54 HD11 HG23 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.44 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.563 ' HA ' HD21 ' A' ' 90' ' ' LEU . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.458 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.401 HG23 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.401 ' CD2' HG23 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.423 HD22 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 58.7 mt -67.77 113.06 12.39 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 9.1 Cg_exo -71.71 -177.81 2.71 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.05 2.5 . . . . 0.0 113.738 -168.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 47.16 1.37 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.453 176.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.6 p -62.04 164.63 6.44 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.783 1.233 . . . . 0.0 111.25 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.1 t -55.82 -38.12 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 C-N-CA 123.233 0.613 . . . . 0.0 110.374 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.7 m 59.56 33.68 22.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.232 1.413 . . . . 0.0 110.483 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.04 102.52 1.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.076 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.563 HD21 ' HA ' ' A' ' 37' ' ' LYS . 91.3 mt 62.66 13.85 6.68 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.038 1.335 . . . . 0.0 112.629 177.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 m -73.94 119.98 18.9 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.558 0.743 . . . . 0.0 111.1 -174.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -62.17 100.9 0.19 Allowed 'General case' 0 C--N 1.354 0.796 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.4 HG22 HD13 ' A' ' 44' ' ' LEU . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.436 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.436 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.495 HG21 HD11 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.495 HD11 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.412 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.55 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.511 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.477 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.528 HG22 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.528 HE21 HG22 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.477 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.511 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.427 ' HB3' HD23 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.06 113.43 9.31 Favored Pre-proline 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -78.78 -170.46 1.0 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.216 2.611 . . . . 0.0 112.332 -176.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -86.34 59.25 5.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.352 0.596 . . . . 0.0 109.773 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 27.6 m -67.69 -45.96 73.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.536 -177.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.479 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 26.9 m -93.74 81.61 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 122.254 1.026 . . . . 0.0 110.676 -176.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.6 t -80.7 -26.16 37.69 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.731 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -87.34 155.14 20.18 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.41 1.084 . . . . 0.0 108.734 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 68.1 tp -54.1 100.64 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.464 1.106 . . . . 0.0 111.853 -174.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.479 ' HB2' ' HB ' ' A' ' 87' ' ' VAL . 74.6 m -150.0 144.19 25.66 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.892 0.877 . . . . 0.0 110.342 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -73.39 122.56 22.27 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.109 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.55 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.406 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.554 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.554 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB3' HG21 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.431 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.524 ' HA ' HD23 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.459 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD13 ' HB3' ' A' ' 91' ' ' SER . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.76 HH22 ' HA ' ' A' ' 86' ' ' THR . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.414 ' O ' HD11 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.543 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.545 ' HA ' HG12 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.545 HG12 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.543 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.517 HD11 ' HD2' ' A' ' 84' ' ' PRO . 64.8 tp -74.07 117.44 61.46 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.517 ' HD2' HD11 ' A' ' 83' ' ' LEU . 60.6 Cg_endo -69.65 97.46 0.63 Allowed 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.529 2.153 . . . . 0.0 112.51 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 -7.34 53.49 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.967 168.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.76 ' HA ' HH22 ' A' ' 45' ' ' ARG . 9.2 t -79.35 -2.1 40.04 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.65 1.18 . . . . 0.0 111.945 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.9 m -108.5 149.38 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.29 0.636 . . . . 0.0 110.925 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.9 m -90.04 -19.55 24.26 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.158 0.983 . . . . 0.0 109.868 170.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -53.5 -65.02 0.64 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.322 1.049 . . . . 0.0 111.533 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.02 93.06 3.87 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.436 ' HB3' HD13 ' A' ' 44' ' ' LEU . 43.1 m -88.95 23.32 2.41 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.624 1.17 . . . . 0.0 111.133 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -84.19 95.16 8.56 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.306 1.042 . . . . 0.0 110.257 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.509 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TRP . . . . . 0.518 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.518 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.477 HD13 ' HB3' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.554 HG22 ' HB2' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD2' ' HD1' ' A' ' 25' ' ' PHE . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.403 ' HD1' ' HD2' ' A' ' 10' ' ' ARG . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.5 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB3' HD13 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HG2' HD12 ' A' ' 46' ' ' ILE . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.528 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.43 HD12 HD13 ' A' ' 80' ' ' LEU . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.484 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.459 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 HD12 ' A' ' 52' ' ' LEU . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.474 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.459 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.422 ' HG3' HD11 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.57 HD21 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HA ' HD13 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.526 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.605 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.433 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.509 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.47 HE22 ' HB2' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.427 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.431 ' OE1' HD22 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.47 ' HB2' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.574 HD23 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp . . . . . 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.477 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.574 ' HE3' HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.408 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.485 HD11 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.426 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.543 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.543 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.447 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.541 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 51' ' ' ARG . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' HB2' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.604 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.475 ' HB3' HG21 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.558 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.558 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.542 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.51 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.407 ' CG ' HG21 ' A' ' 58' ' ' THR . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.599 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.473 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.71 HG22 ' HB2' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.472 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.508 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.556 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.556 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.616 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.552 ' HA ' HG11 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.415 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.552 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.469 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.479 HG12 HD22 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.469 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.426 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.433 ' O ' HG21 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.574 HD11 HG23 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.429 ' HB ' HD13 ' A' ' 3' ' ' LEU . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.669 HG22 ' HB2' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.583 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.43 ' O ' HG22 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.59 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.498 ' HG3' HD22 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.606 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.523 HD13 HD22 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.542 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . 0.583 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.531 HD21 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.602 HG22 ' HB2' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.457 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD21 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.664 ' HB3' HG21 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.493 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.417 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.648 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.461 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.45 ' CG ' HG21 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' HD21 ' A' ' 52' ' ' LEU . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 . . . . . 0 C--O 1.241 0.648 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.418 ' HB2' HG23 ' A' ' 39' ' ' THR . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.404 ' O ' HG12 ' A' ' 32' ' ' ILE . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.418 HG23 ' HB2' ' A' ' 4' ' ' HIS . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 93' ' ' ILE . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.651 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.651 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.572 ' HA ' HG11 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.47 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.545 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.545 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.546 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.8 tp60 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.532 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.532 ' CZ2' HD12 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.442 HD23 ' HB3' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 27' ' ' ALA . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.401 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.425 ' HB3' HG21 ' A' ' 8' ' ' THR . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.438 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.442 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.559 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HD2' HD11 ' A' ' 80' ' ' LEU . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.497 ' HG ' ' HZ3' ' A' ' 73' ' ' TRP . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 62' ' ' ASP . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.44 ' H ' HG22 ' A' ' 60' ' ' VAL . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.486 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.497 ' HZ3' ' HG ' ' A' ' 55' ' ' CYS . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.625 HH21 HD13 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.625 HD13 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.499 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.559 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE3' ' HG2' ' A' ' 36' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.435 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.485 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.515 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HG2' ' HE3' ' A' ' 1' ' ' MET . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' H ' ' HE3' ' A' ' 70' ' ' LYS . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.435 ' HE3' ' H ' ' A' ' 65' ' ' LEU . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.545 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.507 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.714 0.292 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.507 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.52 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.489 ' O ' ' HG2' ' A' ' 48' ' ' ARG . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.404 ' CE2' HG23 ' A' ' 58' ' ' THR . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.047 0.451 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.45 HG13 HD22 ' A' ' 44' ' ' LEU . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.543 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.413 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.583 HG22 ' HB2' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.567 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 8' ' ' THR . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD12 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.57 ' HG3' HD13 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.493 ' HA ' HG11 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.493 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.423 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.423 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.509 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.57 HD13 ' HG3' ' A' ' 51' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp . . . . . 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.458 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.425 ' HE1' HD12 ' A' ' 3' ' ' LEU . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.487 HD11 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.543 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HG3' HD11 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.511 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.587 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.42 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.614 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.467 ' HA ' HG11 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.614 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp . . . . . 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.477 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.426 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.426 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HD13 ' A' ' 80' ' ' LEU . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.606 ' HA ' HG11 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.424 ' CD2' HG21 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.411 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.473 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 121.01 0.433 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.434 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' A' ' 76' ' ' TYR . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.42 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.616 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.532 ' HA ' HG11 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.532 HG11 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.422 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.531 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.531 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HB3' HG21 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 73' ' ' TRP . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.405 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.538 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 121.627 0.727 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.519 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.538 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.519 HD11 HG23 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.504 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.653 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CE2' HG23 ' A' ' 58' ' ' THR . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.409 HG23 ' CE2' ' A' ' 57' ' ' TRP . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.653 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.423 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.524 HG21 HD13 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.432 HG22 ' HB2' ' A' ' 27' ' ' ALA . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.418 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.524 HD13 HG21 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.478 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.556 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.414 ' CD2' HG21 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.459 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.401 ' O ' HG12 ' A' ' 32' ' ' ILE . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.608 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HB2' ' HZ2' ' A' ' 95' ' ' TRP . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.424 ' O ' HD13 ' A' ' 52' ' ' LEU . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.513 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.609 HE21 HG23 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.41 ' HB3' HE22 ' A' ' 59' ' ' GLN . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.474 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.513 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 120.962 0.41 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.608 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.442 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.521 HD21 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 27' ' ' ALA . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.442 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.429 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.43 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.521 ' HA ' HD21 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.459 ' O ' HD13 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.422 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.471 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.562 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 93' ' ' ILE . 64.8 tp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 121.261 0.553 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.495 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TRP . . . . . 0.541 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.477 HD13 ' HB3' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.554 HG22 ' HB2' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD2' ' HD1' ' A' ' 25' ' ' PHE . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.403 ' HD1' ' HD2' ' A' ' 10' ' ' ARG . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.5 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB3' HD13 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HG2' HD12 ' A' ' 46' ' ' ILE . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.528 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.43 HD12 HD13 ' A' ' 80' ' ' LEU . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.484 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.459 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 HD12 ' A' ' 52' ' ' LEU . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.36 124.43 89.84 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.96 121.03 6.8 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.867 2.378 . . . . 0.0 111.773 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.03 95.77 0.06 Allowed 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.5 p -62.02 110.62 1.63 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.829 -168.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.22 129.31 37.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.0 m 57.01 80.74 0.15 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 41' ' ' LEU . 1.5 m-20 -73.96 86.53 1.8 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.261 -164.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.1 mt -121.67 35.33 4.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.832 0.853 . . . . 0.0 109.632 -178.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.3 p -141.62 132.46 25.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.798 0.839 . . . . 0.0 109.261 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.5 107.38 0.57 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.707 0.803 . . . . 0.0 110.082 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.474 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.459 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.422 ' HG3' HD11 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.57 HD21 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HA ' HD13 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.526 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.605 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.433 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.509 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.47 HE22 ' HB2' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.427 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.431 ' OE1' HD22 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.47 ' HB2' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.574 HD23 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp -62.99 120.32 59.99 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 83' ' ' LEU . 18.2 Cg_endo -56.69 133.87 60.79 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.131 2.554 . . . . 0.0 112.463 176.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -171.35 2.29 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.26 0.624 . . . . 0.0 111.234 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.416 HG21 ' HA ' ' A' ' 41' ' ' LEU . 7.5 m -70.67 127.89 34.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.442 0.697 . . . . 0.0 112.474 -170.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 18.1 m -111.61 -164.51 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.337 1.055 . . . . 0.0 108.677 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 t -66.2 -31.14 71.8 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.408 0.549 . . . . 0.0 110.653 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -71.69 106.25 4.01 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.3 tp -72.69 94.3 1.73 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.21 -177.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.0 p -105.77 144.76 32.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.079 0.951 . . . . 0.0 109.418 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -74.78 140.77 44.24 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.477 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.574 ' HE3' HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.408 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.515 ' HG2' ' HG2' ' A' ' 85' ' ' GLU . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.485 HD11 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.426 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.543 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.543 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.447 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.541 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 51' ' ' ARG . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp -72.42 109.19 5.41 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.37 149.7 16.99 Favored 'Trans proline' 0 C--N 1.368 1.584 0 C-N-CA 122.099 1.866 . . . . 0.0 111.947 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -77.86 155.07 31.21 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.015 172.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.3 t -153.85 150.45 28.42 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.507 0.723 . . . . 0.0 109.989 177.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.495 HG23 HG23 ' A' ' 88' ' ' THR . 29.6 m -110.77 -28.91 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.656 0.782 . . . . 0.0 110.838 176.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.495 HG23 HG23 ' A' ' 87' ' ' VAL . 40.4 p -126.41 64.21 1.26 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.54 0.686 . . . . 0.0 110.459 -175.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.71 -83.36 0.05 Allowed 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 171.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.2 mt -131.09 112.37 12.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.6 m -86.57 61.35 6.77 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 121.94 0.876 . . . . 0.0 110.56 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -134.73 150.19 50.55 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.127 1.371 . . . . 0.0 108.008 170.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' HB2' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.604 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.475 ' HB3' HG21 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.558 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.558 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.542 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.51 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.407 ' CG ' HG21 ' A' ' 58' ' ' THR . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.599 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -76.92 109.9 10.3 Favored Pre-proline 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.96 -170.45 0.92 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 122.979 2.453 . . . . 0.0 112.359 -178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.07 163.78 29.53 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.176 0.513 . . . . 0.0 110.047 170.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.471 HG23 HD21 ' A' ' 90' ' ' LEU . 1.9 t -116.94 105.29 12.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.99 0.916 . . . . 0.0 108.827 178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.402 HG23 ' HG ' ' A' ' 41' ' ' LEU . 9.2 p -86.71 66.22 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-O 122.807 1.289 . . . . 0.0 110.22 -177.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.2 p -133.4 -166.07 1.72 Allowed 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.249 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.6 80.39 1.09 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.929 0.891 . . . . 0.0 110.494 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.471 HD21 HG23 ' A' ' 86' ' ' THR . 1.3 pt? 177.31 -172.49 0.1 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 125.02 1.328 . . . . 0.0 109.778 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 p -158.36 100.27 1.66 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.53 0.732 . . . . 0.0 109.772 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -142.4 101.89 3.98 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.473 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.71 HG22 ' HB2' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.472 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.508 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.556 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.556 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.616 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.552 ' HA ' HG11 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.415 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.552 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.469 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.91 145.75 96.93 Favored Pre-proline 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -59.51 139.79 90.95 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 122.249 1.966 . . . . 0.0 110.903 176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.15 111.27 0.73 Allowed 'General case' 0 C--N 1.355 0.835 0 O-C-N 124.097 0.873 . . . . 0.0 109.283 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.4 p -74.69 75.42 2.05 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.591 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.422 HG23 HG22 ' A' ' 88' ' ' THR . 31.3 m -86.08 -33.21 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 167.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.422 HG22 HG23 ' A' ' 87' ' ' VAL . 8.8 t -170.68 144.23 2.29 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 125.758 1.623 . . . . 0.0 107.64 174.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -165.63 162.71 19.07 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.7 mt -105.76 -0.73 25.14 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.171 0.588 . . . . 0.0 111.572 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 m -86.17 152.76 22.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.407 0.683 . . . . 0.0 110.453 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -69.94 123.82 22.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.479 HG12 HD22 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.469 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.433 ' O ' HG21 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.574 HD11 HG23 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.429 ' HB ' HD13 ' A' ' 3' ' ' LEU . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.669 HG22 ' HB2' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.583 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.43 ' O ' HG22 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.59 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.498 ' HG3' HD22 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.606 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.41 108.96 9.86 Favored Pre-proline 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.95 151.3 78.05 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 122.75 2.3 . . . . 0.0 112.583 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.42 -57.89 5.17 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.639 0.733 . . . . 0.0 109.61 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 40.5 p -82.83 85.63 7.06 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 114.253 -1.34 . . . . 0.0 110.506 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.4 m -122.69 133.2 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.763 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.1 t -75.5 -12.57 60.26 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.07 0.548 . . . . 0.0 110.848 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -157.01 99.92 1.85 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.964 0.906 . . . . 0.0 109.431 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 tt -89.0 95.43 10.32 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 169.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.1 m -64.57 -70.66 0.21 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.324 0.65 . . . . 0.0 110.74 -174.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -137.43 157.0 47.53 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.055 0.942 . . . . 0.0 109.17 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.523 HD13 HD22 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.542 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . 0.583 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.531 HD21 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.602 HG22 ' HB2' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.457 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD21 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.664 ' HB3' HG21 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.493 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.511 ' HD3' ' HG3' ' A' ' 85' ' ' GLU . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.417 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.648 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.461 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.45 ' CG ' HG21 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' HD21 ' A' ' 52' ' ' LEU . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 89.8 mt -62.18 136.94 95.68 Favored Pre-proline 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 4.7 Cg_exo -75.69 58.38 5.3 Favored 'Trans proline' 0 C--N 1.384 2.426 0 C-N-CA 123.874 3.049 . . . . 0.0 112.138 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.511 ' HG3' ' HD3' ' A' ' 48' ' ' ARG . 7.9 mm-40 -90.78 9.4 30.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.592 1.157 . . . . 0.0 112.388 -172.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.3 p -60.83 -44.63 96.7 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.25 0.62 . . . . 0.0 109.873 167.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.6 t -104.83 10.97 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 C-N-CA 124.613 1.165 . . . . 0.0 109.732 177.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 85' ' ' GLU . 41.2 p 45.77 80.99 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.212 1.405 . . . . 0.0 112.193 -171.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.16 -41.65 76.96 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.986 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.5 mp -79.05 88.43 4.8 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.872 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.1 p -78.93 -47.15 16.95 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 161.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -86.92 83.26 7.56 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.629 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.418 ' HB2' HG23 ' A' ' 39' ' ' THR . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.404 ' O ' HG12 ' A' ' 32' ' ' ILE . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.418 HG23 ' HB2' ' A' ' 4' ' ' HIS . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB2' HG21 ' A' ' 87' ' ' VAL . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.651 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.651 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.572 ' HA ' HG11 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.47 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.545 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.545 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.546 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.8 tp60 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt -62.43 145.82 94.12 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -51.72 122.55 10.56 Favored 'Trans proline' 0 C--N 1.379 2.165 0 C-N-CA 123.636 2.89 . . . . 0.0 113.13 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -71.96 -28.91 63.74 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.937 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.3 m -72.47 85.46 1.13 Allowed 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 170.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 44' ' ' LEU . 22.1 m -77.8 138.56 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.717 -174.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 41.2 p -77.03 157.43 31.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.326 0.651 . . . . 0.0 111.179 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -74.66 128.01 34.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.756 0.822 . . . . 0.0 110.854 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HA ' HG21 ' A' ' 40' ' ' ILE . 3.0 mm? 52.28 69.85 0.63 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.002 1.321 . . . . 0.0 111.793 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 76.4 p -142.76 144.29 32.57 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.232 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -84.95 107.95 17.33 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.532 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.532 ' CZ2' HD12 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.442 HD23 ' HB3' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 27' ' ' ALA . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.401 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.425 ' HB3' HG21 ' A' ' 8' ' ' THR . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.438 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.442 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.559 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HD2' HD11 ' A' ' 80' ' ' LEU . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.497 ' HG ' ' HZ3' ' A' ' 73' ' ' TRP . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 62' ' ' ASP . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.44 ' H ' HG22 ' A' ' 60' ' ' VAL . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.486 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.497 ' HZ3' ' HG ' ' A' ' 55' ' ' CYS . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.625 HH21 HD13 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 65.4 tp60 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.625 HD13 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.499 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.51 137.52 97.11 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.46 150.77 86.52 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 122.997 2.465 . . . . 0.0 114.586 -167.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -81.45 -8.19 59.69 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.632 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.5 p -133.38 117.16 16.95 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.65 0.78 . . . . 0.0 109.616 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.4 p -80.97 146.79 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.118 0.567 . . . . 0.0 110.896 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.6 p -78.71 -164.13 0.55 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.05 0.94 . . . . 0.0 110.578 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -57.04 -40.2 76.32 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.121 0.968 . . . . 0.0 112.204 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.3 tp -156.42 110.15 2.71 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 124.014 0.925 . . . . 0.0 108.8 177.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -163.29 100.44 0.95 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.067 0.547 . . . . 0.0 109.709 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -73.83 121.19 20.49 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 169.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.559 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE3' ' HG2' ' A' ' 36' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.435 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.485 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.515 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HG2' ' HE3' ' A' ' 1' ' ' MET . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' H ' ' HE3' ' A' ' 70' ' ' LYS . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.435 ' HE3' ' H ' ' A' ' 65' ' ' LEU . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.545 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.507 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp -65.77 146.71 98.98 Favored Pre-proline 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -32.28 112.76 0.05 OUTLIER 'Trans proline' 0 C--N 1.394 2.969 1 C-N-CA 125.424 4.083 . . . . 0.0 115.293 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.34 130.55 44.25 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 124.041 0.838 . . . . 0.0 110.302 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.7 m 60.45 82.65 0.16 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 124.499 1.124 . . . . 0.0 109.079 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.428 HG13 HH11 ' A' ' 48' ' ' ARG . 25.9 m -60.67 142.93 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.039 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 28.6 p -65.21 102.7 0.68 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.691 0.796 . . . . 0.0 110.999 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -61.29 -25.77 67.33 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.146 0.979 . . . . 0.0 112.82 -174.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.632 ' H ' HD23 ' A' ' 90' ' ' LEU . 1.9 pt? -75.41 -14.86 60.48 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.383 0.673 . . . . 0.0 112.277 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.2 t -123.53 167.3 14.08 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.974 0.909 . . . . 0.0 109.488 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -90.66 -178.01 5.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.769 0.428 . . . . 0.0 110.939 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.507 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.565 ' HG ' HG13 ' A' ' 87' ' ' VAL . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HB2' HG21 ' A' ' 87' ' ' VAL . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.404 ' CE2' HG23 ' A' ' 58' ' ' THR . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp -72.44 132.88 83.41 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.86 129.5 22.24 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.912 2.408 . . . . 0.0 114.904 -161.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -68.41 85.74 0.28 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 160.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.439 ' H ' HG22 ' A' ' 93' ' ' ILE . 23.7 m -67.06 82.59 0.12 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.981 0.896 . . . . 0.0 111.415 -172.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.574 HG21 ' HB2' ' A' ' 45' ' ' ARG . 61.3 t -114.97 -20.6 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.879 176.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 24.6 m -48.08 -40.19 22.51 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 124.662 1.185 . . . . 0.0 110.757 170.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -138.85 150.45 46.02 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.896 171.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' A' ' 37' ' ' LYS . 23.6 tp -74.43 91.03 2.21 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HB2' HG21 ' A' ' 86' ' ' THR . 72.9 m -147.08 159.5 43.52 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.264 1.026 . . . . 0.0 109.524 178.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -61.89 143.07 56.96 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.826 0.85 . . . . 0.0 112.06 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.45 HG13 HD22 ' A' ' 44' ' ' LEU . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.543 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.413 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.583 HG22 ' HB2' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.567 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 8' ' ' THR . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD12 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.57 ' HG3' HD13 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.493 ' HA ' HG11 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.493 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.423 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.509 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.57 HD13 ' HG3' ' A' ' 51' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp -48.85 141.79 9.87 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.79 153.14 53.44 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 122.212 1.941 . . . . 0.0 111.685 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -61.82 91.75 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.432 1.093 . . . . 0.0 111.318 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.8 t -65.59 91.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.507 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.9 m -62.0 136.32 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.853 -173.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.275 6.7 t 57.66 -59.6 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 127.202 2.201 . . . . 0.0 114.674 -174.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.66 99.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.504 1.122 . . . . 0.0 111.532 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.8 tp -125.8 35.43 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 122.141 0.972 . . . . 0.0 109.789 -175.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 69.3 m -144.44 -50.6 0.28 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.756 0.822 . . . . 0.0 108.79 175.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 78.71 5.53 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 175.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.458 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.425 ' HE1' HD12 ' A' ' 3' ' ' LEU . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.487 HD11 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.543 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HG3' HD11 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.511 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.587 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.42 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.614 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.467 ' HA ' HG11 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.614 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp -70.51 124.98 91.84 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.11 130.87 18.34 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.662 2.242 . . . . 0.0 111.815 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.23 -49.65 73.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.567 1.147 . . . . 0.0 110.281 178.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.9 p -84.19 76.85 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.496 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -74.75 104.35 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 CA-C-O 121.923 0.868 . . . . 0.0 110.066 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 25.8 m -67.56 -38.3 83.91 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 110.934 -177.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -78.57 154.65 30.18 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.321 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.0 tp -81.14 82.26 7.11 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 175.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 m -137.27 145.38 43.44 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.061 0.944 . . . . 0.0 109.879 -174.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -83.61 152.04 25.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.692 0.797 . . . . 0.0 110.013 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.477 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.426 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.426 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HD13 ' A' ' 80' ' ' LEU . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.606 ' HA ' HG11 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.424 ' CD2' HG21 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.411 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.473 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.55 106.13 0.97 Allowed Pre-proline 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -88.1 61.64 3.26 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.723 2.949 . . . . 0.0 111.164 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -24.44 66.41 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.273 1.029 . . . . 0.0 112.394 177.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.1 t -96.23 13.38 27.65 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.905 0.882 . . . . 0.0 110.744 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.07 130.56 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.434 1.094 . . . . 0.0 108.302 173.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.8 p 52.81 30.77 9.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 125.706 1.602 . . . . 0.0 113.86 176.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -145.61 158.04 43.9 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.903 0.481 . . . . 0.0 111.116 -176.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.94 8.72 1.48 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.595 0.758 . . . . 0.0 111.351 -175.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 -68.68 0.53 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 -173.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -177.86 167.82 2.09 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.664 0.786 . . . . 0.0 111.478 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.434 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' A' ' 76' ' ' TYR . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.42 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.616 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.532 ' HA ' HG11 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.532 HG11 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.422 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt -63.66 132.93 95.35 Favored Pre-proline 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.24 158.0 50.89 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.02 2.48 . . . . 0.0 112.72 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.26 172.22 6.91 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.809 0.844 . . . . 0.0 110.88 -171.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.3 p 55.24 9.69 0.37 Allowed 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 125.593 1.557 . . . . 0.0 114.764 171.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.67 125.53 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.783 0.833 . . . . 0.0 109.966 -172.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.8 p -88.18 84.8 6.88 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.533 0.733 . . . . 0.0 110.228 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -68.6 -43.39 76.54 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.707 0.803 . . . . 0.0 110.489 -178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 53.95 36.82 25.3 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.466 1.506 . . . . 0.0 110.594 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.7 m -139.14 -63.44 0.52 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.603 0.761 . . . . 0.0 109.032 -176.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -172.52 111.13 0.24 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.77 0.828 . . . . 0.0 109.917 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.531 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.531 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HB3' HG21 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 73' ' ' TRP . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.405 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.538 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 4.2 pp -61.44 141.54 94.42 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 25.2 Cg_exo -64.59 159.71 43.5 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 123.003 2.469 . . . . 0.0 112.918 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -100.96 8.07 43.25 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.06 0.544 . . . . 0.0 110.324 173.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.7 p -71.24 91.02 0.93 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.962 0.905 . . . . 0.0 110.874 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t 60.62 68.8 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.25 1.02 . . . . 0.0 110.272 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.7 m -149.4 98.27 2.76 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.643 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.26 -166.67 1.33 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.354 0.662 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.15 -30.77 70.59 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.084 0.953 . . . . 0.0 112.465 -175.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t -107.4 152.85 23.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.461 0.704 . . . . 0.0 109.297 176.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 59.75 81.36 0.17 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.946 1.299 . . . . 0.0 110.113 -175.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.519 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.538 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.519 HD11 HG23 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.7 m120 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.504 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.653 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CE2' HG23 ' A' ' 58' ' ' THR . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.409 HG23 ' CE2' ' A' ' 57' ' ' TRP . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.43 115.48 18.48 Favored Pre-proline 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.78 86.1 1.62 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 C-N-CA 122.29 1.993 . . . . 0.0 110.274 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -64.02 -22.15 66.81 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.035 -1.439 . . . . 0.0 112.394 -171.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.0 p -78.06 98.4 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 109.504 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.2 t 60.51 84.7 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.228 1.411 . . . . 0.0 111.221 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.0 t -127.73 167.36 16.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.061 0.944 . . . . 0.0 109.862 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.83 -3.99 58.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.15 0.58 . . . . 0.0 111.042 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.58 104.37 3.85 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.7 t -70.89 -44.6 65.96 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -100.85 141.09 34.22 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.044 0.937 . . . . 0.0 109.671 176.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.653 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.423 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.524 HG21 HD13 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.432 HG22 ' HB2' ' A' ' 27' ' ' ALA . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.418 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.524 HD13 HG21 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.478 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 90' ' ' LEU . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.556 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.414 ' CD2' HG21 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 58.7 mt -67.77 113.06 12.39 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 9.1 Cg_exo -71.71 -177.81 2.71 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.05 2.5 . . . . 0.0 113.738 -168.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 47.16 1.37 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.453 176.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.6 p -62.04 164.63 6.44 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.783 1.233 . . . . 0.0 111.25 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.1 t -55.82 -38.12 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 C-N-CA 123.233 0.613 . . . . 0.0 110.374 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.7 m 59.56 33.68 22.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.232 1.413 . . . . 0.0 110.483 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.04 102.52 1.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.076 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 37' ' ' LYS . 91.3 mt 62.66 13.85 6.68 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.038 1.335 . . . . 0.0 112.629 177.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 m -73.94 119.98 18.9 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.558 0.743 . . . . 0.0 111.1 -174.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -62.17 100.9 0.19 Allowed 'General case' 0 C--N 1.354 0.796 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.459 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.401 ' O ' HG12 ' A' ' 32' ' ' ILE . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.608 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HB2' ' HZ2' ' A' ' 95' ' ' TRP . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.424 ' O ' HD13 ' A' ' 52' ' ' LEU . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.513 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.609 HE21 HG23 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.41 ' HB3' HE22 ' A' ' 59' ' ' GLN . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.474 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.513 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.06 113.43 9.31 Favored Pre-proline 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -78.78 -170.46 1.0 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.216 2.611 . . . . 0.0 112.332 -176.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -86.34 59.25 5.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.352 0.596 . . . . 0.0 109.773 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 27.6 m -67.69 -45.96 73.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.536 -177.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 26.9 m -93.74 81.61 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 122.254 1.026 . . . . 0.0 110.676 -176.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.6 t -80.7 -26.16 37.69 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.731 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -87.34 155.14 20.18 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.41 1.084 . . . . 0.0 108.734 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 68.1 tp -54.1 100.64 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.464 1.106 . . . . 0.0 111.853 -174.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.451 ' HB2' ' HB ' ' A' ' 87' ' ' VAL . 74.6 m -150.0 144.19 25.66 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.892 0.877 . . . . 0.0 110.342 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -73.39 122.56 22.27 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.109 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.608 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.442 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.521 HD21 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 27' ' ' ALA . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.442 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.429 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.43 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.521 ' HA ' HD21 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.452 HD11 ' HB3' ' A' ' 91' ' ' SER . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.811 HH22 ' HA ' ' A' ' 86' ' ' THR . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.459 ' O ' HD13 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.422 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.471 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.562 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.516 HD12 ' HD2' ' A' ' 84' ' ' PRO . 64.8 tp -74.07 117.44 61.46 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.516 ' HD2' HD12 ' A' ' 83' ' ' LEU . 60.6 Cg_endo -69.65 97.46 0.63 Allowed 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.529 2.153 . . . . 0.0 112.51 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 -7.34 53.49 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.967 168.133 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.811 ' HA ' HH22 ' A' ' 45' ' ' ARG . 9.2 t -79.35 -2.1 40.04 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.65 1.18 . . . . 0.0 111.945 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.9 m -108.5 149.38 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.29 0.636 . . . . 0.0 110.925 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.9 m -90.04 -19.55 24.26 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.158 0.983 . . . . 0.0 109.868 170.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -53.5 -65.02 0.64 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.322 1.049 . . . . 0.0 111.533 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.02 93.06 3.87 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HB3' HD11 ' A' ' 44' ' ' LEU . 43.1 m -88.95 23.32 2.41 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.624 1.17 . . . . 0.0 111.133 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 92' ' ' GLN . 10.1 pt20 -84.19 95.16 8.56 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.306 1.042 . . . . 0.0 110.257 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.495 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TRP . . . . . 0.541 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.477 HD13 ' HB3' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.554 HG22 ' HB2' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD2' ' HD1' ' A' ' 25' ' ' PHE . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.403 ' HD1' ' HD2' ' A' ' 10' ' ' ARG . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.5 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB3' HD13 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HG2' HD12 ' A' ' 46' ' ' ILE . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.528 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.43 HD12 HD13 ' A' ' 80' ' ' LEU . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.484 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.459 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 HD12 ' A' ' 52' ' ' LEU . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.474 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.459 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.422 ' HG3' HD11 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.57 HD21 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HA ' HD13 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.526 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.605 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.433 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.509 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.47 HE22 ' HB2' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.427 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.431 ' OE1' HD22 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.47 ' HB2' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.574 HD23 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp . . . . . 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 . . . . . 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.477 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.574 ' HE3' HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.408 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.485 HD11 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.426 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.543 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.543 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.447 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.541 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 51' ' ' ARG . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 108.008 -1.108 . . . . 0.0 108.008 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' HB2' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.604 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.475 ' HB3' HG21 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.558 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.558 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.542 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.51 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.407 ' CG ' HG21 ' A' ' 58' ' ' THR . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.599 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 . . . . . 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.473 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.71 HG22 ' HB2' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.472 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.508 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.556 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.556 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.616 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.552 ' HA ' HG11 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.415 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.552 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.469 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt . . . . . 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.479 HG12 HD22 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.469 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.426 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.433 ' O ' HG21 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.574 HD11 HG23 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.429 ' HB ' HD13 ' A' ' 3' ' ' LEU . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.669 HG22 ' HB2' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.583 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.43 ' O ' HG22 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.59 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.498 ' HG3' HD22 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.606 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.523 HD13 HD22 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.542 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . 0.583 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.531 HD21 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.602 HG22 ' HB2' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.457 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD21 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.664 ' HB3' HG21 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.493 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.417 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.648 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.628 HE21 HG23 ' A' ' 58' ' ' THR . 23.7 mm-40 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.461 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.45 ' CG ' HG21 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' HD21 ' A' ' 52' ' ' LEU . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 . . . . . 0 C--O 1.241 0.648 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.418 ' HB2' HG23 ' A' ' 39' ' ' THR . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.404 ' O ' HG12 ' A' ' 32' ' ' ILE . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.418 HG23 ' HB2' ' A' ' 4' ' ' HIS . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 93' ' ' ILE . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.651 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.651 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.572 ' HA ' HG11 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.47 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.545 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.545 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.546 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt . . . . . 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 . . . . . 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.532 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.532 ' CZ2' HD12 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.442 HD23 ' HB3' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 27' ' ' ALA . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.401 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.425 ' HB3' HG21 ' A' ' 8' ' ' THR . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.438 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.442 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.559 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HD2' HD11 ' A' ' 80' ' ' LEU . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.497 ' HG ' ' HZ3' ' A' ' 73' ' ' TRP . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 62' ' ' ASP . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.44 ' H ' HG22 ' A' ' 60' ' ' VAL . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.486 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.497 ' HZ3' ' HG ' ' A' ' 55' ' ' CYS . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.625 HH21 HD13 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.625 HD13 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.499 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 . . . . . 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.559 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE3' ' HG2' ' A' ' 36' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.435 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.485 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.515 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HG2' ' HE3' ' A' ' 1' ' ' MET . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' H ' ' HE3' ' A' ' 70' ' ' LYS . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.435 ' HE3' ' H ' ' A' ' 65' ' ' LEU . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.545 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.507 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 120.714 0.292 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.507 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.52 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.489 ' O ' ' HG2' ' A' ' 48' ' ' ARG . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.404 ' CE2' HG23 ' A' ' 58' ' ' THR . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp . . . . . 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 121.047 0.451 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.45 HG13 HD22 ' A' ' 44' ' ' LEU . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.543 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.413 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.583 HG22 ' HB2' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.567 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 8' ' ' THR . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD12 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.57 ' HG3' HD13 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.493 ' HA ' HG11 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.493 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.423 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.423 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.509 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.57 HD13 ' HG3' ' A' ' 51' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp . . . . . 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.458 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.425 ' HE1' HD12 ' A' ' 3' ' ' LEU . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.487 HD11 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.543 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HG3' HD11 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.511 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.587 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.42 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.614 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.467 ' HA ' HG11 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.614 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp . . . . . 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.477 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.426 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.426 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HD13 ' A' ' 80' ' ' LEU . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.606 ' HA ' HG11 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.424 ' CD2' HG21 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.411 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.473 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 121.01 0.433 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.434 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' A' ' 76' ' ' TYR . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.42 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.616 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.532 ' HA ' HG11 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.532 HG11 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.422 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 C--O 1.244 0.768 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.531 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.531 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HB3' HG21 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 73' ' ' TRP . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.405 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.538 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 pp . . . . . 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 121.627 0.727 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.519 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.538 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.519 HD11 HG23 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.504 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.653 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CE2' HG23 ' A' ' 58' ' ' THR . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.409 HG23 ' CE2' ' A' ' 57' ' ' TRP . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.653 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.423 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.478 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.524 HG21 HD13 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.432 HG22 ' HB2' ' A' ' 27' ' ' ALA . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.418 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.524 HD13 HG21 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.478 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.556 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.414 ' CD2' HG21 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.459 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.401 ' O ' HG12 ' A' ' 32' ' ' ILE . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.608 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HB2' ' HZ2' ' A' ' 95' ' ' TRP . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.424 ' O ' HD13 ' A' ' 52' ' ' LEU . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.513 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.609 HE21 HG23 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.41 ' HB3' HE22 ' A' ' 59' ' ' GLN . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.474 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.513 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 . . . . . 0 CA--C 1.546 0.817 0 CA-C-O 120.962 0.41 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.608 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.442 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.521 HD21 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 27' ' ' ALA . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.442 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.429 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.43 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.521 ' HA ' HD21 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.459 ' O ' HD13 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.422 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.471 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.562 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 93' ' ' ILE . 64.8 tp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 CA--C 1.55 0.946 0 CA-C-O 121.261 0.553 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.495 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TRP . . . . . 0.541 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -122.45 148.71 44.8 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.915 0.886 . . . . 0.0 109.5 175.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.477 HD13 ' HB3' ' A' ' 35' ' ' ALA . 16.0 mt -71.98 106.88 4.43 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.383 1.073 . . . . 0.0 111.112 -174.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -52.14 -20.74 2.72 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 13' ' ' ILE . 37.6 p -163.93 117.79 1.49 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.79 0.436 . . . . 0.0 110.718 178.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -117.85 116.38 51.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 169.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 39.3 mt-10 -79.65 84.49 5.48 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.554 HG22 ' HB2' ' A' ' 27' ' ' ALA . 51.8 p -77.02 169.44 21.24 Favored Pre-proline 0 CA--C 1.561 1.369 0 C-N-CA 124.857 1.263 . . . . 0.0 110.301 -177.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -61.56 -25.44 79.4 Favored 'Trans proline' 0 C--N 1.39 2.758 0 C-N-CA 122.408 2.072 . . . . 0.0 113.241 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD2' ' HD1' ' A' ' 25' ' ' PHE . 15.7 ptp180 -88.15 5.08 43.06 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 176.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.86 -166.3 14.61 Favored Glycine 0 N--CA 1.471 1.005 0 C-N-CA 123.0 0.333 . . . . 0.0 112.728 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.428 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 37.9 tt0 -87.84 137.82 32.0 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 5' ' ' SER . 33.5 mm -123.8 138.43 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 178.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -110.27 135.43 51.03 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.619 0.767 . . . . 0.0 109.877 -179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 52.24 87.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.008 1.723 . . . . 0.0 111.876 178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.4 p -151.21 133.67 6.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.973 0.909 . . . . 0.0 110.454 -170.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 t -67.8 162.76 23.27 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.066 0.547 . . . . 0.0 111.19 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.2 -33.82 76.9 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -62.73 -58.06 8.79 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 114.731 -1.122 . . . . 0.0 110.08 177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.61 -46.4 89.99 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.308 1.043 . . . . 0.0 111.444 -175.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.67 -49.72 46.36 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.374 175.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -76.62 -37.85 55.7 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -73.24 -59.61 2.63 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.81 . . . . 0.0 110.705 -169.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 51.9 t -83.94 -60.35 2.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.046 -178.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.403 ' HD1' ' HD2' ' A' ' 10' ' ' ARG . 40.0 m-85 -78.21 -17.61 56.53 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.85 -167.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.63 44.04 83.33 Favored Glycine 0 C--N 1.346 1.094 0 O-C-N 123.61 0.569 . . . . 0.0 113.31 176.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -74.29 147.43 42.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.446 0.699 . . . . 0.0 111.048 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.5 ' O ' HG12 ' A' ' 32' ' ' ILE . 31.5 t -72.67 154.68 40.6 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.702 0.626 . . . . 0.0 110.368 178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -68.81 -25.82 64.87 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.363 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -76.42 -30.91 57.6 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.687 0.795 . . . . 0.0 109.819 172.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.82 -22.67 49.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.691 0.796 . . . . 0.0 110.604 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 28' ' ' SER . 31.8 mm -81.62 -58.23 3.92 Favored 'Isoleucine or valine' 0 C--N 1.359 1.015 0 N-CA-C 107.089 -1.448 . . . . 0.0 107.089 -178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -46.48 -44.8 17.84 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.44 1.096 . . . . 0.0 113.838 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -59.76 -53.05 62.44 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.735 0.414 . . . . 0.0 111.553 175.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB3' HD13 ' A' ' 3' ' ' LEU . . . -65.15 -30.71 71.65 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.681 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -70.77 -48.26 55.28 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.131 0.972 . . . . 0.0 109.545 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 27.6 ttpt -55.4 -38.67 69.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.556 1.142 . . . . 0.0 110.834 173.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.67 24.13 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.4 0.68 . . . . 0.0 110.567 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 97.3 m -75.08 -40.66 59.92 Favored 'General case' 0 C--N 1.353 0.737 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 24.7 mm -59.15 -55.44 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 123.859 0.725 . . . . 0.0 109.093 171.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -52.05 -34.67 44.51 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.622 1.169 . . . . 0.0 112.493 179.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HG2' HD12 ' A' ' 46' ' ' ILE . 48.3 tt0 -79.09 -46.82 17.3 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.6 m -58.93 -50.57 73.54 Favored 'General case' 0 C--O 1.202 -1.427 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.533 -176.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 11.3 mt -64.23 -40.28 95.71 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.105 0.562 . . . . 0.0 111.46 -169.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -69.11 -47.95 63.79 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 122.34 0.256 . . . . 0.0 110.917 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 70.6 mt -66.16 -34.65 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 123.123 0.569 . . . . 0.0 110.162 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.528 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 1.7 mm-40 -64.75 -41.43 95.91 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.894 1.277 . . . . 0.0 110.383 -176.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 15.3 ttm180 -59.35 -50.73 72.86 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 124.101 0.875 . . . . 0.0 108.764 176.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 6.4 m-20 -58.58 -37.12 75.11 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.354 176.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 44.9 mm-40 -61.87 -46.21 90.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.257 0.623 . . . . 0.0 110.381 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 23.2 mmt85 -61.68 -32.08 72.24 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 123.619 0.575 . . . . 0.0 110.935 -178.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.43 HD12 HD13 ' A' ' 80' ' ' LEU . 11.2 mp -75.01 -57.87 3.64 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 122.718 0.407 . . . . 0.0 111.195 176.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 32.9 ptt180 -75.59 -26.38 57.83 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 -169.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.02 -35.62 49.62 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 122.702 0.401 . . . . 0.0 110.075 177.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 77.1 m -87.61 10.73 17.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.361 0.665 . . . . 0.0 111.672 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.09 -14.65 63.14 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.108 0.963 . . . . 0.0 111.791 178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.6 p-90 -63.05 -25.43 68.37 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.615 0.766 . . . . 0.0 111.676 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.484 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.6 p -89.9 -32.21 16.96 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.215 0.606 . . . . 0.0 110.912 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -69.49 -33.22 72.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 114.628 -1.169 . . . . 0.0 110.478 -175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.89 110.35 4.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 167.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -67.21 -6.36 17.75 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.522 0.729 . . . . 0.0 112.478 -171.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.33 -32.15 68.23 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.363 1.065 . . . . 0.0 111.97 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.484 HG11 ' HA ' ' A' ' 58' ' ' THR . 13.9 p -65.59 144.8 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.034 0.534 . . . . 0.0 110.374 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 23.3 t -91.2 84.37 2.15 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 87.4 mt -127.28 161.1 29.39 Favored 'General case' 0 C--O 1.245 0.822 0 C-N-CA 124.381 1.072 . . . . 0.0 108.339 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.2 p -72.37 156.11 39.43 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.79 -41.3 81.81 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.679 0.392 . . . . 0.0 110.697 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -52.64 -51.55 59.56 Favored 'General case' 0 N--CA 1.485 1.31 0 O-C-N 124.098 0.873 . . . . 0.0 112.322 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.0 -54.25 49.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 123.593 0.558 . . . . 0.0 110.18 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -60.19 -24.31 64.69 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.597 1.159 . . . . 0.0 112.629 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.53 -45.17 13.88 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 -177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.6 m -52.21 -40.27 61.33 Favored 'General case' 0 CA--C 1.554 1.128 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.427 169.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.459 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 91.1 m95 -77.54 -33.3 54.21 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.688 0.795 . . . . 0.0 111.974 177.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.48 -25.22 63.06 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 122.871 0.468 . . . . 0.0 110.364 174.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -81.06 -33.55 33.36 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 115.111 -0.949 . . . . 0.0 109.002 175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 65.6 t80 -55.07 -53.38 56.61 Favored 'General case' 0 C--N 1.356 0.872 0 O-C-N 123.935 0.772 . . . . 0.0 110.008 178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 62.7 mtt180 -58.84 -53.17 61.35 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.189 0.931 . . . . 0.0 110.444 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.0 tp60 -64.64 -23.87 67.4 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.403 -172.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -79.22 -37.1 38.93 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.509 0.723 . . . . 0.0 110.596 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.43 HD13 HD12 ' A' ' 52' ' ' LEU . 4.4 mt -62.4 -37.6 86.39 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.064 0.946 . . . . 0.0 110.514 171.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -80.44 -26.08 38.57 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.552 0.741 . . . . 0.0 111.623 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.85 -33.72 75.3 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.656 0.782 . . . . 0.0 109.355 176.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.36 124.43 89.84 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 163.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -49.96 121.03 6.8 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.867 2.378 . . . . 0.0 111.773 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.03 95.77 0.06 Allowed 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.5 p -62.02 110.62 1.63 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.173 -1.376 . . . . 0.0 111.829 -168.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.22 129.31 37.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 48.0 m 57.01 80.74 0.15 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.575 ' HB2' ' HA ' ' A' ' 41' ' ' LEU . 1.5 m-20 -73.96 86.53 1.8 Allowed 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 114.363 -1.29 . . . . 0.0 111.261 -164.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 70.1 mt -121.67 35.33 4.91 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.832 0.853 . . . . 0.0 109.632 -178.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 53.3 p -141.62 132.46 25.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.798 0.839 . . . . 0.0 109.261 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -59.5 107.38 0.57 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.707 0.803 . . . . 0.0 110.082 -178.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.411 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.9 pp -73.05 124.83 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.348 0.659 . . . . 0.0 110.62 179.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.7 t -123.18 115.95 47.13 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.474 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -137.68 163.57 47.39 Favored Pre-proline 0 N--CA 1.469 0.525 0 C-N-CA 124.731 1.212 . . . . 0.0 109.945 -174.6 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.8 135.79 42.71 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 122.57 2.18 . . . . 0.0 113.832 177.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -81.63 147.12 29.73 Favored 'General case' 0 C--O 1.242 0.694 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 159.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.0 pp -58.91 144.54 81.54 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 122.7 0.4 . . . . 0.0 112.033 -177.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -65.75 -40.54 16.91 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.956 2.438 . . . . 0.0 113.766 -175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.459 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 48.1 t . . . . . 0 C--O 1.247 0.971 0 C-N-CA 123.731 0.812 . . . . 0.0 109.578 -172.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.422 ' HG3' HD11 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.4 pp -120.71 152.64 38.0 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.998 0.919 . . . . 0.0 109.672 173.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.57 HD21 ' HG3' ' A' ' 18' ' ' GLU . 25.0 mt -69.6 102.8 1.93 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 170.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -43.86 -36.89 2.55 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 124.498 1.119 . . . . 0.0 112.558 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 p -154.39 125.7 7.38 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 p -138.59 141.08 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -96.82 138.39 34.45 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.605 HG22 ' HB2' ' A' ' 27' ' ' ALA . 53.5 p -125.79 163.63 37.98 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 125.056 1.342 . . . . 0.0 109.279 -178.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -57.95 -26.68 75.8 Favored 'Trans proline' 0 C--N 1.375 1.943 0 C-N-CA 122.545 2.163 . . . . 0.0 113.375 170.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -90.55 2.34 55.88 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.915 0.886 . . . . 0.0 112.835 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 136.91 -150.48 20.61 Favored Glycine 0 N--CA 1.482 1.73 0 CA-C-O 120.028 -0.318 . . . . 0.0 112.473 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -109.46 138.15 46.25 Favored 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 32.6 mm -125.81 122.84 63.01 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.0 mt -104.77 135.1 46.77 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.614 0.766 . . . . 0.0 110.819 -174.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HA ' HD13 ' A' ' 2' ' ' LEU . 74.9 m-20 61.52 73.88 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.794 1.308 . . . . 0.0 111.502 171.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.7 p -150.89 136.94 12.15 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.925 -176.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 59.1 p -62.02 161.33 10.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.458 0.703 . . . . 0.0 111.87 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.57 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.4 mp0 -63.92 -35.58 81.14 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -62.31 -55.61 26.53 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.5 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -70.12 -41.08 74.44 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.308 0.643 . . . . 0.0 111.372 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.17 -47.83 68.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.862 0.465 . . . . 0.0 112.153 174.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -69.01 -44.48 72.68 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.816 0.341 . . . . 0.0 111.418 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -77.46 -61.25 2.05 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.342 0.657 . . . . 0.0 111.411 -168.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.31 -48.24 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.723 0.809 . . . . 0.0 111.098 -174.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.526 ' HB3' HG21 ' A' ' 8' ' ' THR . 81.6 m-85 -88.73 -10.05 49.75 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 61.96 39.33 97.41 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.553 0.533 . . . . 0.0 113.805 173.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.605 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -73.66 156.26 38.15 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.728 0.811 . . . . 0.0 110.983 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.433 ' O ' HG12 ' A' ' 32' ' ' ILE . 41.1 m -88.03 149.15 24.16 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.76 0.824 . . . . 0.0 110.22 -177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -64.26 -26.83 68.67 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.331 0.652 . . . . 0.0 111.817 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -70.05 -35.61 74.39 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.491 0.717 . . . . 0.0 109.943 173.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -25.36 40.7 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.842 0.857 . . . . 0.0 110.342 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' ' 27' ' ' ALA . 30.0 mm -81.58 -39.38 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 -174.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -79.73 -37.32 35.79 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 114.869 -1.059 . . . . 0.0 109.223 -173.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.12 -45.75 92.07 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.909 0.484 . . . . 0.0 110.628 174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.32 -37.57 80.7 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.257 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -62.97 -52.54 62.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.685 0.794 . . . . 0.0 109.635 176.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 25.4 ttpt -49.53 -42.94 45.27 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.906 1.282 . . . . 0.0 111.3 173.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.38 17.52 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.604 0.565 . . . . 0.0 110.184 -168.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.8 m -73.3 -34.12 65.57 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.354 0.662 . . . . 0.0 110.839 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.497 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.8 mm -63.31 -57.19 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.509 ' HG ' HH21 ' A' ' 45' ' ' ARG . 0.2 OUTLIER -55.32 -25.94 37.65 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.38 1.072 . . . . 0.0 112.151 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -79.12 -49.4 12.66 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.732 0.813 . . . . 0.0 109.321 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 97.5 m -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.487 -174.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 49.0 mt -59.22 -44.08 92.3 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.753 0.821 . . . . 0.0 111.336 -176.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.509 HH21 ' HG ' ' A' ' 41' ' ' LEU . 10.8 ptp180 -74.03 -28.74 61.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.222 179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.1 mt -73.2 -39.04 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 122.854 0.461 . . . . 0.0 110.401 178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 43' ' ' THR . 7.8 mm-40 -56.75 -38.38 72.35 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.186 0.994 . . . . 0.0 112.452 -174.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.499 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.1 OUTLIER -62.07 -47.22 85.64 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.082 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -63.74 -40.82 97.65 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.46 0.704 . . . . 0.0 110.193 -178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -54.7 -52.85 61.12 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 124.21 0.943 . . . . 0.0 111.896 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.3 mtp85 -68.81 -40.18 79.69 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.805 0.691 . . . . 0.0 111.019 -173.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 88.8 mt -61.3 -51.34 69.29 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.639 0.776 . . . . 0.0 110.282 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -75.28 -21.58 58.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.064 0.545 . . . . 0.0 111.555 -176.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.58 -17.28 60.75 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.946 0.498 . . . . 0.0 111.187 176.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -98.56 27.28 4.91 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.91 0.884 . . . . 0.0 110.768 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.73 -32.74 46.93 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 122.293 -0.254 . . . . 0.0 111.142 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.5 p-90 -60.68 -26.82 67.38 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.514 0.725 . . . . 0.0 111.699 -174.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -81.52 -37.21 28.2 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.854 0.862 . . . . 0.0 111.372 178.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.47 HE22 ' HB2' ' A' ' 74' ' ' ALA . 9.4 mm100 -84.93 -12.33 53.6 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.319 -169.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.6 m -78.46 159.52 4.71 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 CA-C-O 120.992 0.425 . . . . 0.0 110.286 172.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -82.72 -6.46 59.4 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.776 0.83 . . . . 0.0 111.677 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -71.26 -27.86 63.75 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.917 0.887 . . . . 0.0 111.752 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -93.5 148.35 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.018 0 C-N-CA 123.177 0.591 . . . . 0.0 109.891 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.9 t -100.39 89.05 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.1 mt -123.11 154.78 38.15 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 175.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.427 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.2 p -72.81 164.05 27.18 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.74 -45.92 74.21 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.456 0.472 . . . . 0.0 110.166 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -49.65 -49.92 45.38 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 124.688 1.195 . . . . 0.0 113.077 173.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.431 ' OE1' HD22 ' A' ' 65' ' ' LEU . 73.3 mt-30 -66.33 -53.19 39.28 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.804 0.69 . . . . 0.0 110.784 -177.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.544 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 85.7 mttt -64.0 -24.45 67.72 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.329 1.052 . . . . 0.0 112.208 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.487 ' O ' ' HD3' ' A' ' 75' ' ' LYS . . . -79.56 -57.55 3.63 Favored 'General case' 0 C--O 1.205 -1.255 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 50.8 m -51.62 -32.59 29.59 Favored 'General case' 0 CA--C 1.566 1.59 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 73.8 m95 -72.35 -34.4 67.99 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-N 118.025 0.375 . . . . 0.0 111.477 171.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.47 ' HB2' HE22 ' A' ' 59' ' ' GLN . . . -71.41 -27.67 63.47 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.559 0.744 . . . . 0.0 111.464 173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.487 ' HD3' ' O ' ' A' ' 71' ' ' ALA . 1.2 mptm? -79.62 -31.27 41.6 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.01 0.924 . . . . 0.0 108.726 178.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -65.89 -47.6 74.29 Favored 'General case' 0 C--N 1.355 0.816 0 O-C-N 123.898 0.749 . . . . 0.0 109.653 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -59.85 -50.75 72.56 Favored 'General case' 0 C--N 1.348 0.532 0 O-C-N 124.196 0.935 . . . . 0.0 109.1 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -59.68 -42.84 93.82 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.043 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.0 -51.41 69.75 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.845 0.716 . . . . 0.0 110.616 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 52' ' ' LEU . 5.5 tt -66.06 -49.19 68.52 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.212 1.005 . . . . 0.0 110.488 -175.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -67.5 -25.81 66.04 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.933 0.493 . . . . 0.0 111.263 -175.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.624 0.77 . . . . 0.0 110.093 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.574 HD23 ' HE3' ' A' ' 95' ' ' TRP . 48.5 tp -62.99 120.32 59.99 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.194 177.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.528 ' HD2' HD12 ' A' ' 83' ' ' LEU . 18.2 Cg_endo -56.69 133.87 60.79 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.131 2.554 . . . . 0.0 112.463 176.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.07 -171.35 2.29 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.26 0.624 . . . . 0.0 111.234 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.416 HG21 ' HA ' ' A' ' 41' ' ' LEU . 7.5 m -70.67 127.89 34.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.442 0.697 . . . . 0.0 112.474 -170.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 18.1 m -111.61 -164.51 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.337 1.055 . . . . 0.0 108.677 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 10.1 t -66.2 -31.14 71.8 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.408 0.549 . . . . 0.0 110.653 174.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -71.69 106.25 4.01 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 172.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.3 tp -72.69 94.3 1.73 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.21 -177.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.0 p -105.77 144.76 32.06 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.079 0.951 . . . . 0.0 109.418 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -74.78 140.77 44.24 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.477 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 40.3 pt -90.45 111.58 23.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 124.255 1.022 . . . . 0.0 110.487 -177.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -128.08 108.47 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.704 0.764 . . . . 0.0 109.513 172.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.574 ' HE3' HD23 ' A' ' 83' ' ' LEU . 0.3 OUTLIER -130.93 159.65 70.39 Favored Pre-proline 0 CA--C 1.546 0.789 0 C-N-CA 124.939 1.296 . . . . 0.0 108.962 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.18 160.8 32.91 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.381 2.054 . . . . 0.0 113.913 -170.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -82.71 146.96 28.75 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.046 170.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.09 144.12 98.2 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 122.586 0.354 . . . . 0.0 110.824 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -53.4 -50.12 15.02 Favored 'Trans proline' 0 C--N 1.381 2.285 0 C-N-CA 123.75 2.967 . . . . 0.0 113.977 -168.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.359 0.664 . . . . 0.0 110.743 -174.036 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.408 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.2 tmt? . . . . . 0 N--CA 1.48 1.065 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.0 pp -131.63 158.64 40.52 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.567 0.747 . . . . 0.0 110.088 173.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.79 104.71 3.51 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.359 1.064 . . . . 0.0 109.138 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -52.51 -33.4 44.98 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.662 0.785 . . . . 0.0 112.748 173.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 p -158.51 114.86 2.74 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.152 0.581 . . . . 0.0 110.103 -176.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.4 p -125.12 144.67 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.97 0.908 . . . . 0.0 109.482 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -93.79 121.16 34.95 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.518 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.3 p -117.38 160.7 36.72 Favored Pre-proline 0 CA--C 1.553 1.07 0 C-N-CA 125.165 1.386 . . . . 0.0 108.797 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.67 -14.92 43.04 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.697 2.265 . . . . 0.0 113.499 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -94.63 -4.12 48.29 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.65 0.78 . . . . 0.0 112.208 177.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 135.1 -148.24 19.49 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-O 119.97 -0.35 . . . . 0.0 112.923 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -101.32 130.72 47.54 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.5 mm -119.29 113.37 41.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 mt -93.61 146.93 23.45 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.159 0.984 . . . . 0.0 110.425 -178.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 61.2 m-20 51.91 78.2 0.13 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.313 1.445 . . . . 0.0 111.339 171.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.19 138.11 8.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.515 -168.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.4 p -74.77 165.09 25.8 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.671 0.389 . . . . 0.0 111.119 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -62.71 -34.96 78.23 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.542 0.737 . . . . 0.0 110.367 176.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -64.33 -59.51 4.29 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.183 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.77 -46.95 87.59 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.453 1.096 . . . . 0.0 110.627 -172.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.9 -52.54 40.97 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.752 175.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -73.46 -35.79 65.78 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -78.2 -58.09 3.44 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.665 0.786 . . . . 0.0 111.078 -170.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.6 t -88.24 -43.53 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 123.865 0.866 . . . . 0.0 111.518 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -97.01 -10.31 26.44 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -169.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 63.21 42.32 99.41 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 123.584 0.553 . . . . 0.0 113.764 176.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.54 139.05 40.57 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.728 0.811 . . . . 0.0 110.736 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.45 ' O ' HG12 ' A' ' 32' ' ' ILE . 42.0 t -74.69 151.61 39.23 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.388 0.675 . . . . 0.0 110.546 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -64.6 -24.89 67.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.655 0.382 . . . . 0.0 111.08 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -66.89 -39.62 87.51 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 170.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.88 -24.26 44.34 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.136 0.974 . . . . 0.0 110.128 -177.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 28' ' ' SER . 23.5 mm -80.76 -41.86 20.13 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -173.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.54 -34.65 53.78 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.208 -0.905 . . . . 0.0 108.701 -175.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -63.92 -49.06 74.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.646 1.178 . . . . 0.0 111.987 176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.64 -35.47 60.45 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.341 -175.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.2 ttp180 -61.04 -49.49 77.17 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.605 171.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -55.53 -34.46 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.345 1.028 . . . . 0.0 111.051 174.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.33 -46.3 28.27 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -170.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.0 m -68.54 -39.22 81.21 Favored 'General case' 0 C--N 1.353 0.752 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.033 -179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.2 mm -63.55 -59.59 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.478 0.711 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -52.42 -27.85 17.53 Favored 'General case' 0 N--CA 1.502 2.149 0 C-N-CA 124.969 1.308 . . . . 0.0 112.236 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 46' ' ' ILE . 21.9 tt0 -78.53 -53.18 7.49 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -64.52 -33.25 75.47 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.674 1.19 . . . . 0.0 112.635 -172.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 21.1 mt -60.01 -34.34 73.22 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.493 0.663 . . . . 0.0 110.13 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.515 ' HG2' ' HG2' ' A' ' 85' ' ' GLU . 72.8 mtt180 -95.68 -19.16 19.93 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.988 -177.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.485 HD11 ' HG2' ' A' ' 42' ' ' GLN . 72.0 mt -75.0 -60.33 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 174.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.9 mm-40 -52.78 -40.89 63.6 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.189 0.996 . . . . 0.0 112.558 -172.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.426 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -58.21 -49.84 75.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.085 0.24 . . . . 0.0 110.71 175.735 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -63.92 -37.38 87.19 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.523 0.729 . . . . 0.0 110.801 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -57.48 -49.85 74.97 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.804 0.69 . . . . 0.0 110.888 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 40.9 mtp180 -71.0 -31.81 68.44 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.777 -175.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 48' ' ' ARG . 95.0 mt -68.35 -51.54 43.21 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.25 0.62 . . . . 0.0 110.412 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 20.6 ptt85 -75.42 -22.4 57.42 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.249 0.619 . . . . 0.0 111.36 -176.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.34 -27.06 38.39 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.098 0.559 . . . . 0.0 110.795 175.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.541 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 64.6 m -102.01 33.7 2.96 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.573 0.749 . . . . 0.0 109.745 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -90.56 -22.45 21.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.002 0.921 . . . . 0.0 110.185 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.413 ' O ' HG12 ' A' ' 60' ' ' VAL . 52.7 p-90 -55.33 -35.87 65.65 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.996 0.918 . . . . 0.0 111.567 179.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.543 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.1 t -83.4 -23.69 32.26 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.082 0.953 . . . . 0.0 111.672 -177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 58' ' ' THR . 27.1 mm-40 -86.73 -22.92 25.71 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.43 0.692 . . . . 0.0 111.786 -173.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.413 HG12 ' O ' ' A' ' 57' ' ' TRP . 9.0 p -72.37 153.58 7.67 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 C-N-CA 123.016 0.526 . . . . 0.0 110.594 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -70.69 -18.25 62.82 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.764 0.826 . . . . 0.0 111.576 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -63.8 -46.81 83.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.082 0.953 . . . . 0.0 112.247 -176.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.543 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.1 p -68.53 143.19 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.129 0.572 . . . . 0.0 110.895 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.8 t -101.56 97.72 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 95.1 mt -133.71 163.5 29.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.589 0.755 . . . . 0.0 109.678 179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.8 p -80.36 164.65 22.96 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.22 95.64 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 122.524 0.329 . . . . 0.0 110.233 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -49.45 -49.68 44.18 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.965 0.906 . . . . 0.0 112.146 174.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -69.48 -52.71 24.0 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.588 0.555 . . . . 0.0 110.939 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.447 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 41.4 mttm -64.15 -28.57 69.85 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.283 1.033 . . . . 0.0 113.267 -176.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.64 -50.82 7.33 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -173.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 89.4 m -51.67 -40.69 60.51 Favored 'General case' 0 CA--C 1.56 1.345 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.728 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -70.04 -40.79 74.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.358 0.663 . . . . 0.0 111.647 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.95 -27.62 65.9 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.042 0.537 . . . . 0.0 110.665 178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -76.56 -39.76 51.78 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.117 0.967 . . . . 0.0 109.103 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.541 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 14.6 t80 -58.79 -51.36 70.31 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.437 172.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 42.6 ttt85 -61.23 -50.06 74.59 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.218 0.949 . . . . 0.0 110.142 -177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -60.97 -42.25 97.96 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.828 0.851 . . . . 0.0 112.09 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.72 82.32 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.687 0.617 . . . . 0.0 111.141 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 51' ' ' ARG . 3.8 tt -60.31 -51.9 67.57 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.268 1.027 . . . . 0.0 110.858 176.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -23.2 59.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.61 0.364 . . . . 0.0 111.344 178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.12 -34.36 77.42 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.665 0.786 . . . . 0.0 109.965 175.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.5 tp -72.42 109.19 5.41 Favored Pre-proline 0 CA--C 1.544 0.732 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 168.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.37 149.7 16.99 Favored 'Trans proline' 0 C--N 1.368 1.584 0 C-N-CA 122.099 1.866 . . . . 0.0 111.947 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.515 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -77.86 155.07 31.21 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.015 172.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.3 t -153.85 150.45 28.42 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.507 0.723 . . . . 0.0 109.989 177.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.495 HG23 HG23 ' A' ' 88' ' ' THR . 29.6 m -110.77 -28.91 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.656 0.782 . . . . 0.0 110.838 176.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.495 HG23 HG23 ' A' ' 87' ' ' VAL . 40.4 p -126.41 64.21 1.26 Allowed 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 121.54 0.686 . . . . 0.0 110.459 -175.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -157.71 -83.36 0.05 Allowed 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 171.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.2 mt -131.09 112.37 12.82 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 68.6 m -86.57 61.35 6.77 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 121.94 0.876 . . . . 0.0 110.56 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -134.73 150.19 50.55 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.127 1.371 . . . . 0.0 108.008 170.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.4 pt -132.54 86.39 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 123.526 0.731 . . . . 0.0 110.276 -172.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.5 t -112.58 87.27 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.68 160.83 26.33 Favored Pre-proline 0 N--CA 1.481 1.085 0 C-N-CA 124.67 1.188 . . . . 0.0 110.078 -178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.26 136.4 46.54 Favored 'Trans proline' 0 C--N 1.385 2.499 0 C-N-CA 123.478 2.785 . . . . 0.0 113.562 -177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -82.9 136.91 34.43 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 pp -69.95 146.83 95.6 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-O 119.44 -0.314 . . . . 0.0 110.804 -173.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -60.46 -27.56 85.08 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 123.34 2.693 . . . . 0.0 114.549 -168.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.025 0.53 . . . . 0.0 110.2 -177.825 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 ppp? . . . . . 0 N--CA 1.478 0.927 0 CA-C-O 121.382 0.61 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -139.39 149.84 44.59 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.651 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.604 HD21 ' HG3' ' A' ' 18' ' ' GLU . 12.7 mt -63.77 101.76 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.625 1.17 . . . . 0.0 111.134 -173.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -46.24 -29.33 1.56 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.557 1.143 . . . . 0.0 113.024 171.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.3 p -160.19 133.5 6.84 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.972 0.909 . . . . 0.0 108.996 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -135.79 149.13 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.24 0.616 . . . . 0.0 110.025 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -92.77 126.92 38.08 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.225 0.61 . . . . 0.0 109.878 177.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.558 HG22 ' HB2' ' A' ' 27' ' ' ALA . 41.7 p -125.5 160.94 53.24 Favored Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.887 1.275 . . . . 0.0 109.795 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -60.9 -27.65 85.13 Favored 'Trans proline' 0 C--N 1.379 2.184 0 C-N-CA 122.708 2.272 . . . . 0.0 111.945 173.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptp85 -90.39 6.69 42.17 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.173 0.989 . . . . 0.0 113.147 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 132.8 -131.9 6.36 Favored Glycine 0 N--CA 1.481 1.646 0 CA-C-N 118.251 0.478 . . . . 0.0 112.474 174.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -132.13 141.47 49.15 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 173.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.8 mm -124.04 118.61 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 123.736 0.814 . . . . 0.0 108.826 -170.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.44 126.17 35.45 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 0.0 110.365 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 63.35 88.91 0.09 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.285 1.434 . . . . 0.0 111.566 172.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -160.22 134.86 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 114.474 -1.239 . . . . 0.0 109.379 -172.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.2 m -66.56 160.87 24.32 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 118.101 0.409 . . . . 0.0 111.476 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.604 ' HG3' HD21 ' A' ' 3' ' ' LEU . 3.6 mp0 -62.69 -36.57 83.34 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 121.66 0.743 . . . . 0.0 110.515 -177.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 19.7 mp0 -74.18 -45.41 48.67 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.105 -1.407 . . . . 0.0 109.62 -173.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -64.49 -46.21 84.01 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.3 0.64 . . . . 0.0 110.646 175.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.17 -49.5 60.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.885 0.874 . . . . 0.0 112.621 175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 67.9 mtp180 -72.56 -38.37 67.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.54 0.336 . . . . 0.0 111.578 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -77.53 -62.47 1.65 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.998 0.519 . . . . 0.0 111.214 -172.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -78.41 -59.53 2.96 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.609 0.764 . . . . 0.0 110.159 -175.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.475 ' HB3' HG21 ' A' ' 8' ' ' THR . 94.6 m-85 -78.44 -20.99 49.83 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -171.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.83 32.26 61.37 Favored Glycine 0 C--N 1.346 1.093 0 O-C-N 123.67 0.606 . . . . 0.0 114.101 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.558 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -67.0 144.87 55.94 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.038 0.935 . . . . 0.0 111.977 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.4 m -71.23 153.04 42.74 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.522 0.729 . . . . 0.0 110.765 -176.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -68.57 -28.03 66.59 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.87 0.468 . . . . 0.0 111.096 -177.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -76.77 -29.5 56.11 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.783 0.833 . . . . 0.0 110.064 172.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.92 -23.92 52.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.642 0.777 . . . . 0.0 110.721 178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 28' ' ' SER . 34.1 mm -82.15 -57.59 4.51 Favored 'Isoleucine or valine' 0 C--N 1.353 0.728 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.81 -48.14 10.96 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.236 1.015 . . . . 0.0 112.89 170.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -57.91 -52.75 64.2 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.343 0.657 . . . . 0.0 111.422 175.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.6 -45.06 94.63 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.99 0.916 . . . . 0.0 112.998 -175.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.6 ttp180 -67.15 -43.29 82.67 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.872 0.869 . . . . 0.0 110.059 -177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 36.7 ttpt -62.26 -35.89 80.37 Favored 'General case' 0 C--O 1.214 -0.774 0 O-C-N 123.799 0.687 . . . . 0.0 110.19 175.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -76.35 -35.05 58.93 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.461 0.476 . . . . 0.0 110.426 -173.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.7 m -77.48 -39.24 47.16 Favored 'General case' 0 C--N 1.354 0.765 0 C-N-CA 123.335 0.654 . . . . 0.0 109.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.5 mm -63.7 -57.48 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 123.422 0.689 . . . . 0.0 109.728 175.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.35 -34.65 58.39 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 124.935 1.294 . . . . 0.0 112.081 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -73.09 -47.78 41.55 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.407 ' O ' ' HG2' ' A' ' 47' ' ' GLU . 22.3 m -55.87 -40.71 73.31 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.924 1.289 . . . . 0.0 111.435 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 14.5 mt -61.17 -54.29 46.19 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.203 0.601 . . . . 0.0 109.823 -178.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -64.27 -32.23 73.74 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.854 -177.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 61.4 mt -73.27 -36.96 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 123.343 0.657 . . . . 0.0 110.708 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 43' ' ' THR . 26.5 mm-40 -57.86 -42.5 84.65 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.697 0.799 . . . . 0.0 111.502 -175.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 51.4 ttm-85 -52.06 -56.3 15.27 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.902 0.751 . . . . 0.0 110.436 177.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 27.1 t70 -61.97 -48.01 82.31 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.432 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -60.35 -37.02 79.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.87 0.868 . . . . 0.0 112.573 -177.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -79.6 -34.25 40.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.704 0.401 . . . . 0.0 111.273 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.599 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 9.5 mp -69.97 -38.35 76.04 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.017 0.527 . . . . 0.0 110.835 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 7.7 ptm180 -77.74 -20.26 53.76 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.911 0.484 . . . . 0.0 110.095 173.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.93 -2.28 23.3 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.655 0.382 . . . . 0.0 111.581 171.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 39.2 m -106.05 -6.78 18.44 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.868 0.867 . . . . 0.0 111.094 171.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -58.41 -32.2 68.41 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.104 0.562 . . . . 0.0 111.747 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 18.1 p-90 -67.74 -33.94 75.86 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.17 0.588 . . . . 0.0 111.805 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.558 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.9 p -79.87 -24.2 41.38 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 118.113 0.415 . . . . 0.0 111.25 179.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 75.9 mm-40 -95.11 -11.99 27.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.397 0.679 . . . . 0.0 112.087 -174.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.8 p -83.96 149.72 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 172.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -74.83 -4.16 36.11 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -70.18 -29.96 66.97 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 123.325 0.65 . . . . 0.0 111.852 179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 58' ' ' THR . 9.8 p -85.53 148.58 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 122.818 0.447 . . . . 0.0 111.427 -175.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.75 106.94 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.876 0 C-N-CA 123.657 0.783 . . . . 0.0 109.218 173.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.542 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -136.49 162.25 33.61 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.439 1.096 . . . . 0.0 108.196 178.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 78.3 p -69.94 160.58 31.61 Favored 'General case' 0 C--O 1.246 0.902 0 O-C-N 123.307 0.38 . . . . 0.0 110.294 174.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.23 -41.52 68.8 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.24 173.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -47.85 -54.88 11.15 Favored 'General case' 0 C--N 1.359 1.007 0 O-C-N 124.409 1.068 . . . . 0.0 111.693 172.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.51 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 18.7 mm-40 -67.7 -51.22 52.14 Favored 'General case' 0 N--CA 1.48 1.074 0 O-C-N 123.779 0.675 . . . . 0.0 111.39 -173.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 94.8 mttt -66.89 -28.34 68.24 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.168 0.587 . . . . 0.0 112.502 -175.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.88 -46.45 12.13 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -177.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.7 m -50.53 -41.64 54.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 124.317 1.011 . . . . 0.0 112.05 169.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.407 ' CG ' HG21 ' A' ' 58' ' ' THR . 46.2 m95 -73.31 -37.1 66.29 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.662 0.785 . . . . 0.0 111.481 177.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -67.64 -32.67 73.52 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.263 174.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -79.17 -33.85 43.64 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.745 1.218 . . . . 0.0 109.371 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.48 -48.12 82.88 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.523 1.129 . . . . 0.0 109.76 171.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.599 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 41.7 ttp180 -66.61 -46.32 76.27 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.519 -178.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.8 mm-40 -62.1 -42.78 99.57 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.402 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -64.29 -45.41 88.14 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.879 0.371 . . . . 0.0 110.201 -179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 95' ' ' TRP . 3.7 tt -62.74 -52.43 63.25 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.092 0.957 . . . . 0.0 111.141 -178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.1 -31.26 72.39 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 0.0 111.613 -176.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -66.4 -47.04 74.58 Favored 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.598 0.759 . . . . 0.0 110.401 -177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -76.92 109.9 10.3 Favored Pre-proline 0 N--CA 1.477 0.919 0 O-C-N 123.627 0.579 . . . . 0.0 109.802 176.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.96 -170.45 0.92 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 122.979 2.453 . . . . 0.0 112.359 -178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -136.07 163.78 29.53 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 121.176 0.513 . . . . 0.0 110.047 170.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.471 HG23 HD21 ' A' ' 90' ' ' LEU . 1.9 t -116.94 105.29 12.17 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.99 0.916 . . . . 0.0 108.827 178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.402 HG23 ' HG ' ' A' ' 41' ' ' LEU . 9.2 p -86.71 66.22 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.482 0 CA-C-O 122.807 1.289 . . . . 0.0 110.22 -177.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 33.2 p -133.4 -166.07 1.72 Allowed 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.249 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.6 80.39 1.09 Allowed 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.929 0.891 . . . . 0.0 110.494 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.471 HD21 HG23 ' A' ' 86' ' ' THR . 1.3 pt? 177.31 -172.49 0.1 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 125.02 1.328 . . . . 0.0 109.778 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 p -158.36 100.27 1.66 Allowed 'General case' 0 C--O 1.242 0.695 0 C-N-CA 123.53 0.732 . . . . 0.0 109.772 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -142.4 101.89 3.98 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 121.506 0.67 . . . . 0.0 109.918 177.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.473 ' O ' HD12 ' A' ' 93' ' ' ILE . 1.8 pp -138.38 108.51 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.119 0.968 . . . . 0.0 109.502 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 65.1 t -114.4 106.75 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.443 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.1 OUTLIER -139.21 162.04 54.22 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 124.151 0.98 . . . . 0.0 109.273 -177.526 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 37.9 Cg_endo -60.91 144.2 99.52 Favored 'Trans proline' 0 C--N 1.376 2.019 0 C-N-CA 122.255 1.97 . . . . 0.0 113.402 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -93.55 139.15 31.08 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 114.644 -1.162 . . . . 0.0 108.035 167.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 146.47 96.0 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -169.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -65.03 -41.55 16.69 Favored 'Trans proline' 0 C--N 1.377 2.07 0 C-N-CA 122.967 2.445 . . . . 0.0 112.777 -176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 85.1 t . . . . . 0 C--O 1.25 1.124 0 C-N-CA 123.689 0.795 . . . . 0.0 109.47 -179.195 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE3' ' HA ' ' A' ' 36' ' ' ARG . 1.2 tmt? . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.7 pp -114.99 154.24 29.15 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.338 1.055 . . . . 0.0 109.394 171.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 38.2 mt -68.56 103.09 1.6 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.39 0.676 . . . . 0.0 111.218 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.8 t60 -41.81 -34.42 0.65 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.013 1.325 . . . . 0.0 113.742 168.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 27.9 t -166.77 124.66 1.34 Allowed 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.295 0.638 . . . . 0.0 109.869 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.8 p -129.17 119.55 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.136 0.974 . . . . 0.0 109.133 174.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -81.02 91.52 6.08 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.71 HG22 ' HB2' ' A' ' 27' ' ' ALA . 16.7 p -87.57 166.52 24.73 Favored Pre-proline 0 CA--C 1.558 1.264 0 C-N-CA 123.945 0.898 . . . . 0.0 110.013 -176.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -55.05 -30.41 69.95 Favored 'Trans proline' 0 C--N 1.388 2.648 0 C-N-CA 122.917 2.412 . . . . 0.0 114.823 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -82.51 -16.21 49.56 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.132 0.573 . . . . 0.0 112.196 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 143.99 -179.09 21.59 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.526 -178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.4 tt0 -86.39 133.4 33.79 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 -177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 29.9 mm -124.06 118.18 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.064 0.946 . . . . 0.0 108.847 -167.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -88.57 144.86 26.05 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.704 0.801 . . . . 0.0 111.135 -177.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 37.52 79.2 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 126.436 1.894 . . . . 0.0 113.735 178.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.17 141.79 32.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.151 176.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 60.9 p -65.93 150.93 47.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.496 0.719 . . . . 0.0 111.046 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -54.93 -47.72 74.07 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.143 0.977 . . . . 0.0 113.075 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -68.49 -40.98 80.71 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.124 -174.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -67.17 -44.4 79.82 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.982 0.513 . . . . 0.0 110.238 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.44 -42.53 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.689 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' ALA . 73.5 mtp180 -68.42 -49.14 62.13 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.813 0.445 . . . . 0.0 112.093 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -77.95 -61.58 1.95 Allowed 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.647 0.592 . . . . 0.0 110.964 -168.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.43 -50.27 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.946 -174.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -92.35 -8.55 44.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.752 0.421 . . . . 0.0 112.068 -170.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.07 16.55 79.62 Favored Glycine 0 C--N 1.352 1.455 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 168.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.23 131.71 45.34 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.438 0.695 . . . . 0.0 111.006 176.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' HG12 ' A' ' 32' ' ' ILE . 20.2 m -82.86 169.82 15.66 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.223 0.609 . . . . 0.0 110.755 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.11 -30.34 71.27 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.365 0.666 . . . . 0.0 111.953 -171.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.43 -28.63 46.75 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.666 0.786 . . . . 0.0 110.226 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.25 -24.52 51.12 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.187 0.995 . . . . 0.0 110.707 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 28' ' ' SER . 46.0 mm -80.23 -55.43 8.81 Favored 'Isoleucine or valine' 0 C--N 1.355 0.846 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -49.87 -38.97 37.84 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.45 1.1 . . . . 0.0 113.888 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -56.97 -53.88 53.01 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.033 0.533 . . . . 0.0 111.166 171.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.2 -25.45 65.24 Favored 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.912 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.472 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 19.8 ttm-85 -68.58 -49.91 55.8 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.659 0.783 . . . . 0.0 108.976 175.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 37' ' ' LYS . 26.9 ttpt -55.81 -34.96 65.82 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.952 175.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.98 -46.19 17.11 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 124.051 0.94 . . . . 0.0 110.813 -173.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 77.4 m -63.6 -58.34 7.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.508 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 28.3 mm -50.28 -46.11 25.14 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 124.429 1.08 . . . . 0.0 111.002 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 tp -45.41 -57.97 3.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.729 1.212 . . . . 0.0 111.728 177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -78.21 -33.02 50.16 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.052 -174.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -70.25 -30.41 67.44 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.055 0.942 . . . . 0.0 111.959 -173.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 24.2 mt -65.39 -39.23 91.95 Favored 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 118.411 0.55 . . . . 0.0 109.546 176.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.556 ' HG2' ' NH2' ' A' ' 48' ' ' ARG . 4.7 tmm_? -65.96 -51.34 59.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.479 177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 85.8 mt -59.33 -56.09 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.238 0.615 . . . . 0.0 111.229 -177.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -51.33 -48.17 62.46 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.639 1.175 . . . . 0.0 112.352 -179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.556 ' NH2' ' HG2' ' A' ' 45' ' ' ARG . 18.6 ttp85 -52.04 -53.27 44.06 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.26 0.975 . . . . 0.0 110.62 175.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -70.84 -24.51 62.55 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.646 0.779 . . . . 0.0 112.081 -177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 26.7 mm-40 -72.51 -36.02 68.27 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.869 0.468 . . . . 0.0 110.258 177.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 57.6 mtt-85 -77.5 -27.24 51.79 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.673 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.447 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 2.9 mm? -76.52 -38.36 55.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.745 0.818 . . . . 0.0 111.432 178.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -73.67 -27.11 61.06 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 117.723 0.238 . . . . 0.0 110.492 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.03 -17.13 63.86 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.482 0.713 . . . . 0.0 112.548 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.616 ' SG ' ' HB3' ' A' ' 77' ' ' ARG . 15.9 p -116.94 2.49 12.76 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.584 0.754 . . . . 0.0 111.771 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -72.1 -39.9 68.57 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.769 0.427 . . . . 0.0 111.248 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 39.1 p-90 -62.9 -23.34 67.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.87 0.868 . . . . 0.0 112.411 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.552 ' HA ' HG11 ' A' ' 63' ' ' VAL . 81.8 p -84.91 -21.83 29.51 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.104 0.562 . . . . 0.0 111.66 -178.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.415 ' HG3' ' HD3' ' A' ' 77' ' ' ARG . 40.9 mm-40 -97.87 -20.78 17.28 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.404 0.681 . . . . 0.0 111.537 -173.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 31.3 m -69.87 155.01 7.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 O-C-N 123.244 0.34 . . . . 0.0 110.447 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -69.43 -16.75 63.55 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.454 0.702 . . . . 0.0 112.294 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.43 -54.14 49.15 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.772 0.829 . . . . 0.0 111.019 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.552 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.2 p -72.7 148.02 9.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.073 -176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 39.0 t -121.64 92.88 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 75.3 mt -109.19 178.97 4.29 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.999 0.92 . . . . 0.0 108.658 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 66.1 p -80.51 165.78 21.81 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 169.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.26 -41.85 85.18 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 172.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -49.77 -57.31 7.58 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 124.416 1.072 . . . . 0.0 111.551 173.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 93.5 mt-30 -63.96 -49.35 72.88 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.37 0.668 . . . . 0.0 110.706 -174.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.646 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.2 mttt -63.65 -24.76 67.92 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.929 0.891 . . . . 0.0 112.562 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.56 -49.87 9.41 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 4.8 m -54.15 -33.75 58.69 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.721 174.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.5 m95 -83.04 -33.15 26.53 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.281 0.632 . . . . 0.0 111.754 174.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.19 -33.83 76.65 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.132 0.573 . . . . 0.0 111.215 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -79.96 -28.36 39.62 Favored 'General case' 0 C--O 1.212 -0.886 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.46 -55.13 30.59 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 123.945 0.778 . . . . 0.0 110.513 175.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 18.8 ptt180 -64.41 -43.38 94.56 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.453 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -71.53 -27.22 63.04 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.025 0.93 . . . . 0.0 112.437 -177.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.469 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -77.2 -30.84 54.96 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.708 0.403 . . . . 0.0 111.15 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.0 -41.74 58.87 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -68.62 -23.91 64.5 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.075 0.55 . . . . 0.0 111.974 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.13 -41.16 83.06 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.031 0.933 . . . . 0.0 109.851 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 77.3 mt -68.91 145.75 96.93 Favored Pre-proline 0 CA--C 1.549 0.926 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -59.51 139.79 90.95 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 122.249 1.966 . . . . 0.0 110.903 176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.15 111.27 0.73 Allowed 'General case' 0 C--N 1.355 0.835 0 O-C-N 124.097 0.873 . . . . 0.0 109.283 -179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.4 p -74.69 75.42 2.05 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.591 -170.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.422 HG23 HG22 ' A' ' 88' ' ' THR . 31.3 m -86.08 -33.21 7.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 167.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.422 HG22 HG23 ' A' ' 87' ' ' VAL . 8.8 t -170.68 144.23 2.29 Favored 'General case' 0 C--O 1.247 0.951 0 C-N-CA 125.758 1.623 . . . . 0.0 107.64 174.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -165.63 162.71 19.07 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 82.7 mt -105.76 -0.73 25.14 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.171 0.588 . . . . 0.0 111.572 179.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 m -86.17 152.76 22.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.407 0.683 . . . . 0.0 110.453 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -69.94 123.82 22.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.479 HG12 HD22 ' A' ' 44' ' ' LEU . 2.0 pp -70.01 85.31 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 CA-C-O 122.171 0.986 . . . . 0.0 111.237 -175.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.6 t -108.56 96.1 4.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -116.27 155.17 48.63 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.68 1.192 . . . . 0.0 109.164 -176.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.469 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 25.6 Cg_endo -57.83 143.65 95.2 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.674 2.25 . . . . 0.0 112.949 -176.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -91.97 147.97 22.55 Favored 'General case' 0 C--O 1.242 0.658 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 169.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.5 144.45 98.62 Favored Pre-proline 0 CA--C 1.552 1.032 0 O-C-N 123.581 0.55 . . . . 0.0 111.948 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -67.58 -41.15 8.99 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.626 2.217 . . . . 0.0 114.0 -175.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.249 1.043 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 -171.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HE1' ' HA ' ' A' ' 36' ' ' ARG . 1.7 tmt? . . . . . 0 N--CA 1.485 1.301 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.433 ' O ' HG21 ' A' ' 39' ' ' THR . 4.1 pp -116.75 153.5 32.29 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 172.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.574 HD11 HG23 ' A' ' 32' ' ' ILE . 13.9 mt -67.89 145.31 54.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.156 0.982 . . . . 0.0 110.763 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -84.14 -40.38 18.29 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.7 t -158.04 103.38 1.85 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.597 -178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.429 ' HB ' HD13 ' A' ' 3' ' ' LEU . 9.4 p -99.2 139.78 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.041 0.536 . . . . 0.0 110.918 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -81.23 120.77 25.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 172.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.669 HG22 ' HB2' ' A' ' 27' ' ' ALA . 78.2 p -120.48 159.43 48.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 124.069 0.948 . . . . 0.0 110.134 -177.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 32.2 Cg_exo -62.7 -18.31 63.46 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.809 2.34 . . . . 0.0 113.166 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.2 ptp180 -100.51 1.61 41.2 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.916 0.887 . . . . 0.0 111.798 -178.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.06 -123.51 2.7 Favored Glycine 0 C--N 1.347 1.176 0 N-CA-C 112.361 -0.296 . . . . 0.0 112.361 178.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -144.08 129.54 18.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 40.1 mm -116.9 133.77 62.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 119.388 0.995 . . . . 0.0 108.691 -174.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 58.1 mt -98.23 130.68 44.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.65 0.78 . . . . 0.0 110.53 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 60.06 86.35 0.1 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 125.411 1.484 . . . . 0.0 111.887 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.8 p -158.66 138.61 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.372 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.6 p -67.19 158.81 30.41 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.894 0.478 . . . . 0.0 111.205 178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -64.68 -25.78 68.09 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 122.958 0.503 . . . . 0.0 110.978 176.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.71 -59.17 4.93 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.773 0.829 . . . . 0.0 110.605 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -67.43 -38.2 84.18 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.473 0.709 . . . . 0.0 111.136 -175.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.1 -52.81 31.81 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.315 0.646 . . . . 0.0 111.972 171.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -66.57 -45.23 79.97 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 122.635 0.374 . . . . 0.0 111.299 178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -77.07 -62.52 1.63 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.765 0.826 . . . . 0.0 111.614 -166.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 75.3 t -77.34 -52.8 15.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.256 1.022 . . . . 0.0 111.247 -176.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -88.02 -8.12 56.05 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -170.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.51 23.28 64.66 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 123.739 0.649 . . . . 0.0 113.764 175.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.669 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -66.73 144.37 56.39 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.289 1.036 . . . . 0.0 111.559 -174.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.0 m -71.13 146.6 49.08 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -67.87 -32.53 73.1 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 123.812 0.695 . . . . 0.0 109.666 -176.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -71.17 -36.31 71.95 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.4 177.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.35 -27.99 59.41 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.532 0.733 . . . . 0.0 110.679 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 3' ' ' LEU . 96.0 mt -83.47 -23.62 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.856 0.863 . . . . 0.0 108.682 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -77.12 -43.94 32.28 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.41 -42.47 98.75 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.356 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.28 -36.64 84.71 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.131 0.572 . . . . 0.0 111.412 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 24.6 ttt180 -64.91 -48.21 75.0 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.912 0.885 . . . . 0.0 109.247 179.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -56.59 -38.56 72.18 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.123 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.04 -34.57 38.18 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 123.569 0.543 . . . . 0.0 109.657 -171.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 2' ' ' LEU . 33.0 m -73.69 -43.87 58.13 Favored 'General case' 0 C--O 1.213 -0.825 0 C-N-CA 122.996 0.518 . . . . 0.0 109.849 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.2 mm -59.63 -58.14 8.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.43 -38.86 20.81 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 125.192 1.397 . . . . 0.0 112.779 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -81.39 -53.33 6.4 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.205 0.602 . . . . 0.0 110.678 -177.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.9 m -59.43 -39.96 85.22 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.541 1.136 . . . . 0.0 111.864 -173.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.6 mt -59.65 -52.9 63.53 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.035 0.534 . . . . 0.0 111.242 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -71.0 -26.92 63.34 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 36.4 mt -68.22 -46.71 80.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.792 0.437 . . . . 0.0 109.997 173.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -51.01 -44.81 61.05 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.324 1.05 . . . . 0.0 110.935 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -55.81 -58.72 6.67 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 124.403 1.064 . . . . 0.0 110.412 -179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 52' ' ' LEU . 10.4 m-20 -70.88 -29.13 65.14 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.525 -172.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -64.78 -52.33 57.49 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.344 0.658 . . . . 0.0 111.314 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.583 ' NH2' ' HA ' ' A' ' 97' ' ' GLN . 11.8 ptm85 -68.95 -26.52 65.1 Favored 'General case' 0 CA--C 1.549 0.913 0 O-C-N 123.472 0.483 . . . . 0.0 111.354 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 80' ' ' LEU . 66.5 mt -67.05 -55.6 13.64 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.521 0.729 . . . . 0.0 111.604 174.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 -72.96 -20.82 60.97 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.578 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.81 -50.19 52.23 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.0 m -76.45 -0.94 24.73 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.697 -178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -67.04 -13.89 62.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 123.884 0.874 . . . . 0.0 111.852 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.43 ' O ' HG22 ' A' ' 60' ' ' VAL . 41.1 p-90 -60.42 -21.62 62.45 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.511 0.725 . . . . 0.0 111.1 176.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -85.74 -12.06 52.03 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.416 0.686 . . . . 0.0 111.928 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -104.59 -19.73 13.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.115 0.966 . . . . 0.0 111.215 -175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 57' ' ' TRP . 17.0 m -65.78 162.42 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.105 0.562 . . . . 0.0 111.567 177.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -76.9 -19.13 57.79 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.449 0.7 . . . . 0.0 111.714 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -66.37 -42.77 87.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.668 0.787 . . . . 0.0 111.934 -178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.448 HG13 ' HE2' ' A' ' 70' ' ' LYS . 11.4 p -70.66 145.29 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -168.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 4.2 p -114.14 106.84 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 124.296 1.039 . . . . 0.0 109.559 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.59 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 73.5 mt -138.55 176.56 8.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 175.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 47.2 p -81.71 160.95 23.54 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.57 -44.56 85.38 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.842 0.457 . . . . 0.0 110.194 176.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -50.38 -55.81 14.11 Favored 'General case' 0 N--CA 1.481 1.088 0 O-C-N 124.583 1.177 . . . . 0.0 112.071 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -60.13 -54.01 51.01 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 123.774 0.671 . . . . 0.0 111.15 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.59 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 91.3 mttt -58.67 -26.33 63.7 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.096 0.958 . . . . 0.0 112.791 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.08 -42.26 16.29 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-O 121.211 0.529 . . . . 0.0 109.682 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.5 m -53.13 -43.17 66.74 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.118 171.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -72.62 -34.93 67.69 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.609 0.763 . . . . 0.0 111.854 176.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -69.08 -26.96 65.2 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 122.725 0.41 . . . . 0.0 110.976 177.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -86.84 -33.12 19.94 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.08 0.952 . . . . 0.0 108.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 57.0 t80 -54.78 -42.25 71.5 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.01 1.324 . . . . 0.0 110.009 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.498 ' HG3' HD22 ' A' ' 52' ' ' LEU . 50.0 ttt85 -61.83 -46.81 87.85 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 123.987 0.804 . . . . 0.0 111.379 178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 11.9 mm100 -68.69 -46.73 68.26 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 123.487 0.492 . . . . 0.0 111.905 -172.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.8 -22.68 66.58 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.706 0.802 . . . . 0.0 111.979 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.606 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.4 tt -89.43 -42.95 11.2 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.311 1.044 . . . . 0.0 109.29 -177.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -65.95 -21.4 66.42 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.702 1.201 . . . . 0.0 111.935 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -41.65 -34.81 0.65 Allowed 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.76 1.224 . . . . 0.0 112.724 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.41 108.96 9.86 Favored Pre-proline 0 CA--C 1.548 0.89 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 171.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.95 151.3 78.05 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 122.75 2.3 . . . . 0.0 112.583 -175.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -68.42 -57.89 5.17 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 121.639 0.733 . . . . 0.0 109.61 178.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 40.5 p -82.83 85.63 7.06 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 114.253 -1.34 . . . . 0.0 110.506 -178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 3.4 m -122.69 133.2 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.763 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.1 t -75.5 -12.57 60.26 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.07 0.548 . . . . 0.0 110.848 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -157.01 99.92 1.85 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.964 0.906 . . . . 0.0 109.431 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.6 tt -89.0 95.43 10.32 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 169.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.1 m -64.57 -70.66 0.21 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.324 0.65 . . . . 0.0 110.74 -174.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -137.43 157.0 47.53 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.055 0.942 . . . . 0.0 109.17 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.523 HD13 HD22 ' A' ' 44' ' ' LEU . 30.4 pt -103.39 126.29 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.102 0.561 . . . . 0.0 111.395 -175.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.2 t -137.45 104.27 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 N-CA-C 107.332 -1.358 . . . . 0.0 107.332 177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.542 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 0.7 OUTLIER -143.15 152.67 58.59 Favored Pre-proline 0 C--O 1.242 0.674 0 C-N-CA 122.788 0.435 . . . . 0.0 110.464 -179.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.8 144.29 93.38 Favored 'Trans proline' 0 C--N 1.375 1.961 0 C-N-CA 122.898 2.399 . . . . 0.0 112.825 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.583 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 30.0 tt0 -91.92 151.11 20.68 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 164.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.07 145.49 12.44 Favored Pre-proline 0 CA--C 1.562 1.411 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -175.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -70.19 -32.35 16.92 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.886 2.391 . . . . 0.0 112.994 -174.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 71.1 t . . . . . 0 C--O 1.249 1.031 0 C-N-CA 123.94 0.896 . . . . 0.0 108.982 -177.03 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 tmt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 pp -134.56 159.08 42.29 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.126 0.97 . . . . 0.0 109.403 171.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.531 HD21 ' HA ' ' A' ' 32' ' ' ILE . 5.7 mp -71.35 101.85 2.47 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.601 0.76 . . . . 0.0 109.558 176.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.3 m170 -51.14 -23.02 2.88 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 175.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.4 t -163.01 139.73 7.42 Favored 'General case' 0 C--O 1.241 0.607 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 173.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.4 p -149.29 133.62 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 124.475 1.11 . . . . 0.0 108.686 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -90.51 104.97 17.49 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.602 HG22 ' HB2' ' A' ' 27' ' ' ALA . 43.4 p -94.51 168.04 12.15 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.498 1.119 . . . . 0.0 109.87 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HD2' ' HB ' ' A' ' 8' ' ' THR . 29.8 Cg_endo -61.5 -24.13 77.71 Favored 'Trans proline' 0 C--N 1.385 2.45 0 C-N-CA 122.962 2.441 . . . . 0.0 113.727 176.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -83.76 -10.21 58.26 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.343 0.257 . . . . 0.0 111.552 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 134.52 -159.71 23.96 Favored Glycine 0 C--N 1.349 1.306 0 N-CA-C 112.103 -0.399 . . . . 0.0 112.103 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -86.42 134.22 33.72 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.1 mm -126.92 122.19 59.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.592 1.157 . . . . 0.0 108.43 -175.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 73.6 mt -100.97 124.14 46.22 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.275 0.63 . . . . 0.0 110.603 -174.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 65.05 87.23 0.12 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.148 1.379 . . . . 0.0 111.898 170.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.1 p -153.63 149.07 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.829 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 79.2 p -70.27 159.1 34.66 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.438 0.695 . . . . 0.0 110.918 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -57.2 -47.21 81.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.334 1.053 . . . . 0.0 111.18 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.457 ' HA ' HH21 ' A' ' 22' ' ' ARG . 76.8 mt-30 -61.08 -58.29 9.0 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.934 -177.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -62.72 -42.5 99.69 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.64 -174.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.56 -54.18 15.46 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 171.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.457 HH21 ' HA ' ' A' ' 19' ' ' GLN . 80.6 mtm180 -64.14 -43.27 95.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.119 0.567 . . . . 0.0 112.126 -177.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -79.52 -61.22 2.07 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.152 -170.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 81.8 t -75.25 -58.78 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 123.713 0.805 . . . . 0.0 110.979 -176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -80.55 -13.88 58.69 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.426 0.69 . . . . 0.0 111.836 -171.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.03 20.74 69.54 Favored Glycine 0 C--N 1.346 1.116 0 CA-C-O 119.825 -0.43 . . . . 0.0 114.078 174.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.602 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -59.29 134.9 57.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.871 0.868 . . . . 0.0 112.187 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.6 m -64.63 143.72 57.72 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 123.95 0.781 . . . . 0.0 110.307 173.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.23 -25.84 65.4 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.567 0.347 . . . . 0.0 110.3 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -66.75 -35.07 79.24 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.174 0.99 . . . . 0.0 111.058 173.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.28 -53.05 13.61 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 176.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.531 ' HA ' HD21 ' A' ' 3' ' ' LEU . 42.8 mm -46.22 -31.09 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 167.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.48 -56.16 4.88 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -57.0 -48.23 78.94 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 115.076 -0.966 . . . . 0.0 113.04 179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.19 -30.07 60.56 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.506 0.722 . . . . 0.0 111.913 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.2 ttm105 -63.74 -53.87 44.32 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 171.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -51.24 -40.54 59.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.89 1.276 . . . . 0.0 111.671 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.4 -36.78 29.12 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.14 0.576 . . . . 0.0 111.233 -172.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -66.96 -44.09 81.45 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 35.0 mm -62.45 -55.12 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.831 0 C-N-CA 123.546 0.738 . . . . 0.0 110.215 174.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -38.3 58.27 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.367 1.067 . . . . 0.0 112.231 -179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 30.5 tt0 -78.79 -49.51 12.87 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.976 -176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 85.6 m -56.06 -54.51 44.07 Favored 'General case' 0 C--O 1.208 -1.126 0 C-N-CA 123.777 0.831 . . . . 0.0 111.147 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.664 ' HB3' HG21 ' A' ' 93' ' ' ILE . 23.5 mt -64.92 -43.8 91.62 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.552 0.741 . . . . 0.0 111.203 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -57.39 -45.77 84.14 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.728 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 66.7 mt -75.42 -36.69 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.286 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.493 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.7 OUTLIER -66.23 -36.34 82.79 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.356 1.062 . . . . 0.0 110.432 -169.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.511 ' HD3' ' HG3' ' A' ' 85' ' ' GLU . 30.8 ttp-105 -56.27 -43.62 78.95 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.188 172.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -78.06 -26.88 48.5 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.15 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 8.7 mm-40 -65.77 -42.96 90.21 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.03 0.532 . . . . 0.0 110.204 176.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.417 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.2 ptp180 -77.96 -24.96 47.95 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.861 179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.452 HD21 ' HB2' ' A' ' 80' ' ' LEU . 23.4 mt -66.22 -50.87 62.35 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.182 0.593 . . . . 0.0 110.743 172.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.6 ptp180 -71.57 -30.39 65.81 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.66 -44.67 66.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.354 0.662 . . . . 0.0 110.638 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 47.5 t -63.34 -15.11 56.39 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.86 0.864 . . . . 0.0 112.159 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -69.21 -10.74 59.2 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.809 0.444 . . . . 0.0 112.035 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 31.9 p-90 -58.56 -35.66 72.71 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 177.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.648 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.6 t -94.28 -19.69 20.47 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.148 0.979 . . . . 0.0 111.192 -177.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.628 HE21 HG23 ' A' ' 58' ' ' THR . 23.7 mm-40 -80.3 -25.09 39.55 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.565 -177.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.0 m -76.65 155.1 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 122.781 0.432 . . . . 0.0 110.725 175.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -84.37 5.17 28.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.53 0.732 . . . . 0.0 112.515 -175.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.24 -45.05 64.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.435 0.694 . . . . 0.0 110.771 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.648 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.0 p -87.77 152.25 3.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.842 0 C-N-CA 123.081 0.552 . . . . 0.0 110.395 -178.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -116.58 121.39 67.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 123.94 0.896 . . . . 0.0 108.815 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 46.8 mt -143.25 165.02 28.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.131 1.372 . . . . 0.0 107.445 177.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.2 p -73.3 159.07 33.95 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.36 -37.78 73.13 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 173.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -49.57 -54.43 18.25 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.557 1.143 . . . . 0.0 111.653 172.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -65.34 -53.89 37.05 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.613 0.765 . . . . 0.0 111.084 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -65.39 -25.39 67.53 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.324 1.049 . . . . 0.0 112.939 -174.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.78 -43.82 16.27 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.461 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 89.9 m -55.18 -40.94 71.27 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.905 171.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.45 ' CG ' HG21 ' A' ' 58' ' ' THR . 59.5 m95 -71.29 -32.55 68.78 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.95 0.9 . . . . 0.0 111.447 173.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.06 -30.9 65.61 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.092 0.557 . . . . 0.0 111.53 -178.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HE2' ' HA ' ' A' ' 72' ' ' THR . 48.0 mtmt -76.26 -34.97 59.14 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.346 0.658 . . . . 0.0 109.691 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -54.26 -51.49 64.36 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.799 1.24 . . . . 0.0 110.244 174.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.0 ttt180 -70.9 -48.05 55.85 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.237 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -49.69 -38.44 32.89 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.259 1.424 . . . . 0.0 113.607 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.41 -51.46 63.07 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.834 0.453 . . . . 0.0 110.597 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB2' HD21 ' A' ' 52' ' ' LEU . 38.7 mt -60.16 -34.34 73.43 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.654 1.182 . . . . 0.0 113.413 -177.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -76.54 -27.48 55.95 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.54 -13.81 55.98 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.003 0.921 . . . . 0.0 111.452 -175.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 89.8 mt -62.18 136.94 95.68 Favored Pre-proline 0 CA--C 1.557 1.24 0 CA-C-O 118.631 -0.699 . . . . 0.0 110.571 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 4.7 Cg_exo -75.69 58.38 5.3 Favored 'Trans proline' 0 C--N 1.384 2.426 0 C-N-CA 123.874 3.049 . . . . 0.0 112.138 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.511 ' HG3' ' HD3' ' A' ' 48' ' ' ARG . 7.9 mm-40 -90.78 9.4 30.27 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.592 1.157 . . . . 0.0 112.388 -172.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.3 p -60.83 -44.63 96.7 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.25 0.62 . . . . 0.0 109.873 167.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.6 t -104.83 10.97 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.393 0 C-N-CA 124.613 1.165 . . . . 0.0 109.732 177.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 85' ' ' GLU . 41.2 p 45.77 80.99 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.212 1.405 . . . . 0.0 112.193 -171.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -69.16 -41.65 76.96 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.986 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.5 mp -79.05 88.43 4.8 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.872 -176.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 49.1 p -78.93 -47.15 16.95 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 161.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -86.92 83.26 7.56 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.629 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.664 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.3 pp -68.03 102.37 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.271 0.557 . . . . 0.0 110.154 -177.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -119.87 85.48 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -109.96 162.32 20.85 Favored Pre-proline 0 C--O 1.243 0.717 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.371 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.23 143.73 99.64 Favored 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 122.247 1.965 . . . . 0.0 113.129 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.3 tp60 -92.87 140.0 29.95 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 169.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.7 pp -63.36 141.06 97.81 Favored Pre-proline 0 CA--C 1.55 0.972 0 O-C-N 123.383 0.427 . . . . 0.0 111.459 -176.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -61.1 -20.05 66.03 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.795 2.997 . . . . 0.0 114.421 -169.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 CA--C 1.559 1.298 0 C-N-CA 123.538 0.735 . . . . 0.0 110.007 -178.335 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 tmt? . . . . . 0 N--CA 1.481 1.117 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 pp -117.46 155.77 29.13 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.648 1.179 . . . . 0.0 109.161 174.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.43 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 60.3 mt -56.48 147.78 21.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.505 0.722 . . . . 0.0 111.413 174.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.418 ' HB2' HG23 ' A' ' 39' ' ' THR . 55.0 t-80 -100.86 -35.99 9.22 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.692 0.797 . . . . 0.0 109.458 -174.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.7 t -165.26 95.08 0.66 Allowed 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.166 -0.925 . . . . 0.0 108.695 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -104.71 122.63 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.657 0.783 . . . . 0.0 110.102 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 46.3 mt-10 -85.35 92.86 8.58 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 27' ' ' ALA . 22.7 p -75.73 162.69 71.18 Favored Pre-proline 0 CA--C 1.555 1.149 0 CA-C-N 114.227 -1.351 . . . . 0.0 109.553 176.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -53.12 -26.63 33.7 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 122.9 2.4 . . . . 0.0 115.018 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -90.57 -12.68 36.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.805 0.842 . . . . 0.0 112.349 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 146.24 -173.12 26.64 Favored Glycine 0 N--CA 1.475 1.254 0 C-N-CA 122.679 0.18 . . . . 0.0 112.662 178.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.446 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 40.5 tt0 -87.79 134.97 33.58 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 46.7 mm -131.09 116.98 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.448 1.099 . . . . 0.0 108.359 -171.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.76 156.08 21.56 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.653 0.781 . . . . 0.0 111.258 -176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.43 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 7.2 p30 31.76 72.59 0.07 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 126.502 1.921 . . . . 0.0 115.166 172.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.6 m -134.47 154.77 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 123.322 0.649 . . . . 0.0 110.422 178.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.8 t -75.06 141.45 43.84 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.131 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -51.69 -37.79 52.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.882 0.873 . . . . 0.0 111.729 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -66.55 -43.35 85.31 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.831 0.852 . . . . 0.0 111.885 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -70.81 -47.78 57.63 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.958 0.503 . . . . 0.0 110.287 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -50.85 14.38 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 124.313 1.008 . . . . 0.0 112.496 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -72.77 -31.41 64.87 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -78.44 -63.89 1.3 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.95 0.5 . . . . 0.0 110.866 -172.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 42.4 t -81.28 -51.34 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 124.223 1.009 . . . . 0.0 111.075 -175.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -87.93 -2.94 58.92 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.197 -171.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.97 33.98 70.7 Favored Glycine 0 C--N 1.353 1.5 0 O-C-N 123.936 0.772 . . . . 0.0 113.971 175.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.35 133.26 52.3 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.064 0.946 . . . . 0.0 112.054 -172.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.404 ' O ' HG12 ' A' ' 32' ' ' ILE . 6.5 m -59.76 139.49 57.25 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 124.231 0.957 . . . . 0.0 110.1 175.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -70.85 -25.11 62.68 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.439 0.296 . . . . 0.0 110.947 -177.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -61.17 -40.08 92.55 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.888 0.875 . . . . 0.0 110.487 168.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.51 -51.31 17.49 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.603 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -44.35 -38.27 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 167.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.18 7.27 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -55.51 -47.49 76.14 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 114.843 -1.071 . . . . 0.0 112.803 176.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.24 -29.63 62.9 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.553 1.158 . . . . 0.0 110.925 -175.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -69.01 -47.28 65.87 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 172.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -58.51 -35.62 72.54 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.569 172.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.23 -41.18 35.08 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.192 0.597 . . . . 0.0 110.432 -174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.418 HG23 ' HB2' ' A' ' 4' ' ' HIS . 87.5 m -63.62 -48.57 76.78 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 124.088 0.867 . . . . 0.0 109.239 177.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.5 mm -58.51 -61.09 1.52 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 O-C-N 124.219 0.95 . . . . 0.0 109.634 177.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.4 -35.23 60.13 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 124.46 1.104 . . . . 0.0 112.283 -176.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -76.49 -49.23 17.09 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.329 0.652 . . . . 0.0 109.308 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 66.1 m -67.25 -37.64 83.85 Favored 'General case' 0 C--O 1.196 -1.756 0 CA-C-N 114.353 -1.294 . . . . 0.0 111.022 -174.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HB2' HG21 ' A' ' 87' ' ' VAL . 13.2 mt -63.6 -27.25 69.11 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 119.034 0.833 . . . . 0.0 110.973 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -82.28 -56.24 4.03 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.964 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.1 mt -60.02 -37.02 70.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.896 0.878 . . . . 0.0 112.253 -174.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.607 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.9 OUTLIER -55.51 -53.14 60.03 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.665 1.586 . . . . 0.0 110.03 -173.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.525 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 18.7 ptp180 -65.22 -38.81 91.57 Favored 'General case' 0 C--N 1.353 0.761 0 O-C-N 124.602 1.189 . . . . 0.0 110.941 -177.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -63.38 -39.25 94.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.014 0.526 . . . . 0.0 110.493 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.92 -27.97 66.24 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.294 177.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 37.1 mtp85 -79.38 -33.75 42.57 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.343 0.257 . . . . 0.0 111.024 174.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.651 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 75.8 mt -72.77 -32.73 65.82 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.274 0.63 . . . . 0.0 110.67 -176.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -76.91 -33.38 57.76 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 171.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.05 -0.33 18.61 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.17 0.588 . . . . 0.0 111.968 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.651 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 28.1 p -124.97 8.31 8.05 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.96 0.904 . . . . 0.0 110.585 169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -98.7 -17.07 18.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.92 0.888 . . . . 0.0 110.697 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.3 p-90 -63.0 -26.0 68.65 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.549 0.34 . . . . 0.0 110.113 174.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.572 ' HA ' HG11 ' A' ' 63' ' ' VAL . 41.0 p -82.18 -24.91 34.71 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.89 0.876 . . . . 0.0 111.71 177.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.47 ' HG3' ' NH1' ' A' ' 77' ' ' ARG . 33.4 mm-40 -84.09 -23.77 30.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.626 0.77 . . . . 0.0 112.214 -173.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 10.3 p -71.08 148.43 10.52 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.028 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 174.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -76.75 -7.82 56.11 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.38 -44.66 84.63 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.725 0.81 . . . . 0.0 110.601 175.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.572 HG11 ' HA ' ' A' ' 58' ' ' THR . 12.8 p -83.85 141.87 14.2 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.984 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.9 t -106.57 105.04 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.545 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 71.1 mt -128.54 166.83 18.06 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.235 1.014 . . . . 0.0 108.874 178.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 74.8 p -72.73 162.01 30.02 Favored 'General case' 0 C--O 1.243 0.747 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 175.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.93 -41.94 83.79 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.857 0.463 . . . . 0.0 109.83 175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -49.91 -56.77 9.28 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.292 1.037 . . . . 0.0 112.284 171.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -58.16 -57.53 12.45 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 123.922 0.763 . . . . 0.0 110.539 -177.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.545 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 54.5 mttm -60.32 -25.5 65.84 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.275 1.03 . . . . 0.0 112.888 -177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.73 -47.85 10.02 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 33.2 m -50.35 -43.74 54.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.461 1.104 . . . . 0.0 111.945 172.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -72.54 -34.76 67.76 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.255 0.622 . . . . 0.0 111.433 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.54 68.89 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.201 0.6 . . . . 0.0 111.275 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -86.66 -32.97 20.25 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.332 0.653 . . . . 0.0 109.378 -178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -62.3 -54.45 40.44 Favored 'General case' 0 C--N 1.35 0.616 0 C-N-CA 123.833 0.853 . . . . 0.0 110.208 176.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.546 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 13.4 ptm180 -61.57 -36.81 81.7 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 124.047 0.842 . . . . 0.0 110.014 -177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -70.23 -37.93 75.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.955 0.902 . . . . 0.0 111.197 178.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.21 -17.0 59.72 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.658 0.783 . . . . 0.0 111.377 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.7 tt -86.13 -52.26 5.79 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -22.07 66.18 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.481 176.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -50.29 -37.35 35.84 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.512 1.125 . . . . 0.0 111.655 175.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 95' ' ' TRP . 85.5 mt -62.43 145.82 94.12 Favored Pre-proline 0 CA--C 1.553 1.067 0 C-N-CA 123.573 0.749 . . . . 0.0 111.146 176.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -51.72 122.55 10.56 Favored 'Trans proline' 0 C--N 1.379 2.165 0 C-N-CA 123.636 2.89 . . . . 0.0 113.13 -178.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -71.96 -28.91 63.74 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.937 177.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.3 m -72.47 85.46 1.13 Allowed 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 170.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.49 HG21 ' HB2' ' A' ' 44' ' ' LEU . 22.1 m -77.8 138.56 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 114.559 -1.2 . . . . 0.0 110.717 -174.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 41.2 p -77.03 157.43 31.15 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.326 0.651 . . . . 0.0 111.179 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -74.66 128.01 34.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.756 0.822 . . . . 0.0 110.854 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.443 ' HA ' HG21 ' A' ' 40' ' ' ILE . 3.0 mm? 52.28 69.85 0.63 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.002 1.321 . . . . 0.0 111.793 177.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 76.4 p -142.76 144.29 32.57 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.232 -177.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -84.95 107.95 17.33 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.636 0.731 . . . . 0.0 109.245 175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.532 HD12 ' CZ2' ' A' ' 95' ' ' TRP . 3.5 pt -59.26 132.5 24.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.546 173.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 6.1 p -133.03 121.65 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.501 0.72 . . . . 0.0 109.134 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.532 ' CZ2' HD12 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -139.31 164.98 35.07 Favored Pre-proline 0 N--CA 1.477 0.924 0 C-N-CA 124.874 1.269 . . . . 0.0 109.485 -179.137 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -59.43 151.49 68.17 Favored 'Trans proline' 0 C--N 1.389 2.696 0 C-N-CA 121.921 1.747 . . . . 0.0 112.616 -177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -84.17 144.13 29.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.946 172.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.22 146.61 95.89 Favored Pre-proline 0 CA--C 1.548 0.873 0 O-C-N 123.536 0.523 . . . . 0.0 111.191 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -58.11 -47.17 21.29 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 122.787 2.325 . . . . 0.0 113.458 -169.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 36.3 t . . . . . 0 C--O 1.247 0.939 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -174.742 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 tmm? . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.9 152.73 22.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 170.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.442 HD23 ' HB3' ' A' ' 35' ' ' ALA . 4.4 mp -77.66 106.12 9.26 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.4 m-70 -54.81 -14.14 1.3 Allowed 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.562 1.145 . . . . 0.0 113.788 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.8 p -158.33 128.75 6.14 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.767 0.827 . . . . 0.0 108.851 175.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.74 110.79 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 174.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 44.1 tt0 -77.98 96.77 5.14 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 27' ' ' ALA . 28.6 p -91.82 164.5 23.65 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.181 0.992 . . . . 0.0 108.62 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.01 -4.5 10.31 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.368 2.045 . . . . 0.0 114.404 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -102.94 4.52 37.61 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.086 0.554 . . . . 0.0 111.661 173.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 121.72 175.38 14.94 Favored Glycine 0 C--N 1.344 1.023 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 39.5 tt0 -81.35 141.73 33.73 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 42.9 mm -123.66 110.13 25.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -171.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -81.71 119.89 24.42 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.365 0.666 . . . . 0.0 110.545 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 65.41 77.81 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.655 1.582 . . . . 0.0 112.202 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.7 p -137.92 143.72 32.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.689 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.438 175.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.0 m -71.46 149.7 45.61 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 172.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 2.2 mp0 -54.36 -38.1 65.71 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 123.834 0.709 . . . . 0.0 110.878 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.401 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 12.0 pt20 -57.96 -54.24 49.2 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.462 0.705 . . . . 0.0 112.242 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -68.87 -38.37 79.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.902 0.481 . . . . 0.0 110.387 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.08 46.54 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.649 171.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 64.5 mtm180 -59.11 -55.03 40.21 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 121.437 0.637 . . . . 0.0 111.24 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -77.61 -61.84 1.86 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 114.283 -1.326 . . . . 0.0 111.374 -163.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.1 t -79.57 -53.61 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.281 0.633 . . . . 0.0 110.679 -172.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.425 ' HB3' HG21 ' A' ' 8' ' ' THR . 74.2 m-85 -79.98 -13.89 59.0 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.319 -173.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.23 40.8 99.47 Favored Glycine 0 C--N 1.35 1.31 0 O-C-N 123.354 0.409 . . . . 0.0 113.002 177.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.438 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -69.91 140.08 53.06 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.683 0.793 . . . . 0.0 111.245 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.1 t -67.84 146.97 53.16 Favored 'General case' 0 C--O 1.239 0.52 0 O-C-N 124.098 0.874 . . . . 0.0 109.855 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.8 -22.82 63.28 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 123.932 0.77 . . . . 0.0 109.797 175.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -59.01 -46.31 88.51 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.913 0.885 . . . . 0.0 111.06 168.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.05 -56.64 4.53 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.429 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.0 mt -45.06 -34.85 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 169.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.46 -57.88 3.61 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.481 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 30.3 t70 -51.19 -50.62 58.69 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.971 1.308 . . . . 0.0 113.007 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.442 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -75.0 -29.68 60.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.208 -0.905 . . . . 0.0 112.007 -174.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.26 -53.65 45.72 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 171.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 34' ' ' ASP . 31.0 ttpt -51.28 -41.58 60.54 Favored 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.756 1.285 . . . . 0.0 111.991 176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.71 -40.84 24.64 Favored 'General case' 0 N--CA 1.471 0.608 0 O-C-N 123.488 0.492 . . . . 0.0 111.296 -172.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.6 m -63.34 -48.56 77.47 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 123.612 0.57 . . . . 0.0 109.599 176.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.7 mm -57.46 -57.33 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.047 0.939 . . . . 0.0 110.624 175.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.83 -32.02 42.15 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.274 1.03 . . . . 0.0 111.866 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -79.12 -43.04 24.87 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.403 0.681 . . . . 0.0 110.203 177.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.1 m -69.27 -26.67 64.88 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.429 1.092 . . . . 0.0 111.314 -175.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.4 mt -65.89 -25.97 67.41 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.172 0.51 . . . . 0.0 110.226 176.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 70.8 mtm180 -92.35 -36.26 13.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.326 1.051 . . . . 0.0 110.9 177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.43 -55.02 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 123.21 0.604 . . . . 0.0 110.776 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -51.39 -40.49 59.37 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.53 1.132 . . . . 0.0 113.115 -173.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.559 ' HB3' ' CZ3' ' A' ' 95' ' ' TRP . 14.5 ptt180 -63.64 -52.93 58.62 Favored 'General case' 0 C--N 1.359 0.983 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.16 -35.12 77.85 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.076 0.55 . . . . 0.0 111.097 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -67.19 -44.48 79.56 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.234 0.614 . . . . 0.0 111.559 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.42 ' HD2' HD11 ' A' ' 80' ' ' LEU . 94.1 mtt180 -66.7 -39.74 88.2 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.539 0.524 . . . . 0.0 110.585 179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' A' ' 81' ' ' ARG . 10.6 mp -64.89 -44.66 88.87 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.771 0.669 . . . . 0.0 111.198 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 18.6 ptp180 -80.7 -21.37 41.32 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.49 -38.01 74.3 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.186 0.517 . . . . 0.0 110.391 178.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.497 ' HG ' ' HZ3' ' A' ' 73' ' ' TRP . 28.5 m -93.55 29.12 2.07 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.903 178.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.63 -31.49 68.17 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.797 0.839 . . . . 0.0 110.786 175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 p-90 -63.09 -36.95 85.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.406 -178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.9 p -75.38 -27.17 59.0 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.537 0.335 . . . . 0.0 111.094 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -87.6 -22.61 24.67 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 123.983 0.802 . . . . 0.0 111.572 -173.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 62' ' ' ASP . 9.6 p -81.95 144.84 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.6 -9.78 58.91 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 122.904 0.481 . . . . 0.0 111.602 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.44 ' H ' HG22 ' A' ' 60' ' ' VAL . 25.3 t70 -60.13 -37.3 79.64 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.222 1.009 . . . . 0.0 111.846 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.05 148.65 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 CA-C-O 120.775 0.321 . . . . 0.0 110.315 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.7 m -107.55 82.32 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-O 122.591 1.186 . . . . 0.0 110.369 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.486 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 89.0 mt -115.03 164.03 14.75 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 114.047 -1.433 . . . . 0.0 108.34 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 70.5 p -71.81 156.69 39.03 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.34 -42.1 73.37 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 122.838 0.455 . . . . 0.0 110.299 175.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -49.96 -55.49 14.35 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.255 1.022 . . . . 0.0 112.286 172.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -62.4 -47.37 84.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.305 0.642 . . . . 0.0 110.912 -176.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 83.9 mttt -63.91 -25.83 68.32 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.076 0.951 . . . . 0.0 112.208 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.98 -48.98 10.07 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -177.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -50.11 -43.37 51.68 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.591 1.156 . . . . 0.0 111.154 173.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.497 ' HZ3' ' HG ' ' A' ' 55' ' ' CYS . 69.7 m95 -68.47 -42.24 79.0 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.242 0.617 . . . . 0.0 111.677 174.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.45 64.27 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.29 0.636 . . . . 0.0 111.916 -178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -80.7 -38.13 29.44 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.73 0.812 . . . . 0.0 109.482 177.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -59.33 -40.48 86.48 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.981 0.912 . . . . 0.0 110.37 170.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.625 HH21 HD13 ' A' ' 80' ' ' LEU . 8.4 mmp_? -62.03 -56.0 23.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.447 0.699 . . . . 0.0 111.252 176.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.24 -35.09 74.68 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.312 1.008 . . . . 0.0 111.649 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.78 -58.91 4.12 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.585 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.625 HD13 HH21 ' A' ' 77' ' ' ARG . 4.2 tt -54.04 -47.83 71.18 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.528 1.131 . . . . 0.0 112.414 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.499 ' HB3' HD21 ' A' ' 52' ' ' LEU . 13.5 ptm180 -64.41 -23.72 67.38 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.107 0.563 . . . . 0.0 111.927 -173.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.32 -28.86 63.45 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.417 1.087 . . . . 0.0 111.501 178.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.51 137.52 97.11 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 123.562 0.745 . . . . 0.0 110.151 174.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -65.46 150.77 86.52 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 122.997 2.465 . . . . 0.0 114.586 -167.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -81.45 -8.19 59.69 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.632 171.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.5 p -133.38 117.16 16.95 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.65 0.78 . . . . 0.0 109.616 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.4 p -80.97 146.79 6.94 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.118 0.567 . . . . 0.0 110.896 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.6 p -78.71 -164.13 0.55 Allowed 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.05 0.94 . . . . 0.0 110.578 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -57.04 -40.2 76.32 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.121 0.968 . . . . 0.0 112.204 -178.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.3 tp -156.42 110.15 2.71 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 124.014 0.925 . . . . 0.0 108.8 177.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.1 t -163.29 100.44 0.95 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.067 0.547 . . . . 0.0 109.709 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -73.83 121.19 20.49 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 169.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.1 pp -60.7 120.29 6.22 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.597 178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 4.3 p -108.1 115.29 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.559 ' CZ3' ' HB3' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -137.68 155.33 75.15 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 123.823 0.849 . . . . 0.0 109.803 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -60.52 153.99 57.14 Favored 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.673 2.249 . . . . 0.0 114.305 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -83.83 155.15 23.1 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.434 169.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 98' ' ' LEU . 0.6 OUTLIER -57.14 136.99 80.64 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 122.942 0.497 . . . . 0.0 111.627 177.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.53 -22.91 32.47 Favored 'Trans proline' 0 C--N 1.372 1.814 0 C-N-CA 123.723 2.949 . . . . 0.0 113.718 -168.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 81.3 t . . . . . 0 C--O 1.248 0.986 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.042 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.489 ' HE3' ' HG2' ' A' ' 36' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.9 pp -114.38 153.47 29.79 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.881 1.272 . . . . 0.0 109.26 171.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 18' ' ' GLU . 25.3 mt -72.92 108.65 5.96 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.49 0.716 . . . . 0.0 111.459 177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -41.31 -38.31 1.15 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 125.096 1.358 . . . . 0.0 113.578 167.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.0 p -165.9 109.85 0.81 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.057 0.543 . . . . 0.0 110.498 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.435 ' HA ' ' HB2' ' A' ' 35' ' ' ALA . 15.0 p -101.73 144.94 12.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 123.28 0.632 . . . . 0.0 110.153 174.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -94.83 108.88 20.91 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 27' ' ' ALA . 82.0 p -113.25 161.11 28.63 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 124.55 1.14 . . . . 0.0 110.108 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -59.77 -15.45 32.04 Favored 'Trans proline' 0 C--N 1.383 2.383 0 C-N-CA 123.017 2.478 . . . . 0.0 114.432 176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.485 HH11 ' HD1' ' A' ' 25' ' ' PHE . 0.2 OUTLIER -100.35 -13.2 18.89 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.405 0.682 . . . . 0.0 111.945 -178.165 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 150.13 -153.13 24.89 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 175.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.05 135.57 42.28 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 171.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mm -122.48 123.88 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.1 mt -100.24 150.58 22.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.653 0.781 . . . . 0.0 111.941 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 p30 43.55 42.68 4.16 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 126.476 1.91 . . . . 0.0 113.097 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -111.77 141.01 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.337 -170.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.1 t -63.21 149.31 45.75 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.554 0.741 . . . . 0.0 109.391 170.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -75.17 -23.7 57.78 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.599 0.36 . . . . 0.0 111.511 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -64.58 -48.61 74.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.19 -47.1 84.02 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.21 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.38 -54.02 24.9 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.759 177.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.2 mtm180 -74.96 -32.2 61.65 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.98 -62.81 1.53 Allowed 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 121.127 0.489 . . . . 0.0 111.277 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.3 t -78.83 -60.67 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 124.186 0.994 . . . . 0.0 110.956 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.485 ' HD1' HH11 ' A' ' 10' ' ' ARG . 72.2 m-85 -81.28 -10.48 59.57 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.283 -168.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.77 47.28 77.36 Favored Glycine 0 C--N 1.346 1.088 0 O-C-N 123.787 0.679 . . . . 0.0 113.736 175.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.75 148.37 28.96 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 123.45 0.7 . . . . 0.0 110.77 178.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.515 ' O ' HG12 ' A' ' 32' ' ' ILE . 47.5 t -82.18 156.89 24.21 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.447 176.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.91 -25.59 64.67 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.377 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -79.06 -33.28 44.79 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.567 0.747 . . . . 0.0 109.81 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.66 -22.71 59.88 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.916 0.886 . . . . 0.0 110.194 176.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 28' ' ' SER . 26.0 mm -78.86 -56.8 6.39 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -45.44 -42.84 10.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.584 1.154 . . . . 0.0 113.596 173.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -64.85 -48.6 73.74 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.736 0.414 . . . . 0.0 111.904 176.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.435 ' HB2' ' HA ' ' A' ' 6' ' ' VAL . . . -65.87 -31.88 73.08 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.492 0.717 . . . . 0.0 111.898 178.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.489 ' HG2' ' HE3' ' A' ' 1' ' ' MET . 1.8 tmt_? -68.83 -46.44 68.58 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 125.241 1.416 . . . . 0.0 108.314 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.08 -37.65 74.88 Favored 'General case' 0 C--O 1.211 -0.928 0 CA-C-N 114.671 -1.149 . . . . 0.0 110.68 173.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.7 -40.71 40.46 Favored 'General case' 0 C--O 1.243 0.761 0 C-N-CA 123.348 0.659 . . . . 0.0 110.681 -171.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 50.2 m -69.66 -48.0 61.32 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.478 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 33.7 mm -61.59 -45.11 99.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 O-C-N 124.243 0.965 . . . . 0.0 110.616 177.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.0 -36.01 64.98 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.809 0.843 . . . . 0.0 111.193 176.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.441 ' HA ' ' NH2' ' A' ' 45' ' ' ARG . 17.6 tt0 -74.14 -43.53 57.11 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 123.313 0.645 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.5 m -61.13 -54.16 48.03 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.314 1.446 . . . . 0.0 112.393 -173.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 13.4 mt -61.21 -28.64 69.29 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 123.456 0.703 . . . . 0.0 111.318 -172.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HA ' ' A' ' 42' ' ' GLN . 48.6 mtm105 -77.67 -42.79 33.39 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.71 176.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mt -71.38 -44.74 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 123.354 0.662 . . . . 0.0 112.383 -175.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -50.7 -50.02 56.16 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 124.242 1.017 . . . . 0.0 112.132 -172.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' HD23 ' A' ' 52' ' ' LEU . 16.3 ptm180 -63.48 -50.63 68.93 Favored 'General case' 0 C--N 1.35 0.627 0 O-C-N 124.256 0.972 . . . . 0.0 111.178 -177.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -58.9 -39.32 81.12 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 118.244 0.475 . . . . 0.0 110.888 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -66.51 -48.08 70.91 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.196 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -73.55 -25.28 60.31 Favored 'General case' 0 N--CA 1.484 1.235 0 CA-C-N 118.073 0.397 . . . . 0.0 111.434 -178.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 48' ' ' ARG . 3.4 mm? -63.96 -52.87 57.71 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.341 0.656 . . . . 0.0 109.93 173.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -78.42 -18.6 54.75 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.476 -178.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.65 -43.88 62.6 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.758 0.423 . . . . 0.0 109.89 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.545 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 81.7 m -75.46 -2.32 28.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.694 0.798 . . . . 0.0 112.424 179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.33 -9.02 58.19 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.293 1.037 . . . . 0.0 111.455 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -59.3 -25.36 64.07 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.404 0.682 . . . . 0.0 111.168 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 68.7 p -84.78 -33.78 22.92 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.766 0.826 . . . . 0.0 111.426 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.7 mm-40 -66.42 -35.71 80.99 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.062 0.945 . . . . 0.0 111.647 -174.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.5 m -70.26 160.12 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 O-C-N 123.815 0.697 . . . . 0.0 111.79 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -87.83 -5.52 58.57 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.563 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.95 -33.76 74.87 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.652 0.781 . . . . 0.0 110.673 175.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.9 p -91.61 148.78 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.195 0.598 . . . . 0.0 109.52 173.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.4 t -112.06 93.67 2.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' H ' ' HE3' ' A' ' 70' ' ' LYS . 67.9 mt -124.19 158.32 32.67 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.602 1.161 . . . . 0.0 108.66 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.5 p -69.17 164.94 21.5 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 122.547 0.339 . . . . 0.0 110.221 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.49 -45.24 85.1 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 173.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -49.11 -47.88 45.01 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.495 1.118 . . . . 0.0 112.39 174.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -62.38 -63.35 1.26 Allowed 'General case' 0 N--CA 1.483 1.213 0 O-C-N 123.944 0.778 . . . . 0.0 110.225 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.435 ' HE3' ' H ' ' A' ' 65' ' ' LEU . 90.8 mttt -64.14 -26.32 68.48 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.158 0.983 . . . . 0.0 113.224 -171.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.37 -49.92 7.74 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.248 0.619 . . . . 0.0 110.059 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 97.2 m -50.44 -44.63 55.52 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.933 169.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -68.06 -35.76 78.75 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.503 0.721 . . . . 0.0 111.232 175.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 78' ' ' GLN . . . -66.62 -36.56 82.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.241 0.617 . . . . 0.0 111.121 176.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -79.3 -33.57 43.18 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.136 0.974 . . . . 0.0 109.6 -173.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.545 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 32.5 t80 -60.22 -47.12 87.32 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.307 1.043 . . . . 0.0 110.092 170.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 55.8 ttp85 -62.37 -50.2 72.5 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.232 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 74' ' ' ALA . 30.9 mm-40 -62.87 -31.25 72.25 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.657 0.783 . . . . 0.0 112.123 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.19 -46.6 55.62 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.045 0.538 . . . . 0.0 111.489 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.507 ' HG ' ' HD2' ' A' ' 96' ' ' PRO . 2.2 tt -73.29 -40.27 64.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.21 0.604 . . . . 0.0 110.36 -171.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -64.67 -26.45 68.39 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 0.0 110.621 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -77.28 -5.94 51.31 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.478 1.111 . . . . 0.0 111.752 -177.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 80' ' ' LEU . 11.0 mp -65.77 146.71 98.98 Favored Pre-proline 0 N--CA 1.486 1.329 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.676 172.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -32.28 112.76 0.05 OUTLIER 'Trans proline' 0 C--N 1.394 2.969 1 C-N-CA 125.424 4.083 . . . . 0.0 115.293 -178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -64.34 130.55 44.25 Favored 'General case' 0 N--CA 1.471 0.613 0 O-C-N 124.041 0.838 . . . . 0.0 110.302 -179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.7 m 60.45 82.65 0.16 Allowed 'General case' 0 CA--C 1.542 0.637 0 O-C-N 124.499 1.124 . . . . 0.0 109.079 -168.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.428 HG13 HH11 ' A' ' 48' ' ' ARG . 25.9 m -60.67 142.93 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.039 -178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 28.6 p -65.21 102.7 0.68 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.691 0.796 . . . . 0.0 110.999 -176.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -61.29 -25.77 67.33 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.146 0.979 . . . . 0.0 112.82 -174.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.632 ' H ' HD23 ' A' ' 90' ' ' LEU . 1.9 pt? -75.41 -14.86 60.48 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 123.383 0.673 . . . . 0.0 112.277 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 34.2 t -123.53 167.3 14.08 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.974 0.909 . . . . 0.0 109.488 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -90.66 -178.01 5.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.769 0.428 . . . . 0.0 110.939 179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.2 pp -131.18 136.27 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.66 0.784 . . . . 0.0 111.431 -169.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.9 t -124.59 119.65 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 107.969 -1.122 . . . . 0.0 107.969 165.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -121.87 158.41 54.77 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 123.649 0.78 . . . . 0.0 110.104 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.507 ' HD2' ' HG ' ' A' ' 80' ' ' LEU . 72.4 Cg_exo -51.09 140.25 40.89 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.744 2.296 . . . . 0.0 112.956 174.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -90.18 144.91 25.43 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 171.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -68.62 152.05 96.89 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 123.155 0.582 . . . . 0.0 111.551 -177.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -64.08 -11.41 27.36 Favored 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 123.389 2.726 . . . . 0.0 115.543 -168.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.556 1.176 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 179.334 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 ppp? . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 121.011 0.434 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -109.44 150.1 28.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.195 171.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mp -69.4 106.5 2.96 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.506 1.122 . . . . 0.0 109.0 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -46.2 -30.48 2.0 Allowed 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 176.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.7 t -169.22 127.48 0.99 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.148 0.979 . . . . 0.0 109.168 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.5 p -115.24 152.73 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 124.227 1.011 . . . . 0.0 109.5 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -89.02 134.03 34.13 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 174.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.4 p -137.69 158.79 71.08 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 124.174 0.99 . . . . 0.0 110.084 -176.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.27 -31.9 85.96 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.05 2.5 . . . . 0.0 113.503 171.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -82.0 -3.98 55.7 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.33 0.652 . . . . 0.0 112.252 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.09 -127.99 5.69 Favored Glycine 0 C--N 1.345 1.067 0 C-N-CA 123.104 0.383 . . . . 0.0 112.476 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -117.69 131.26 56.65 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.64 0.776 . . . . 0.0 109.09 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.1 mm -119.58 123.54 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 123.75 0.82 . . . . 0.0 109.283 -176.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -95.78 140.53 30.44 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.769 0.828 . . . . 0.0 110.552 -177.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 67.4 m-20 52.78 84.64 0.05 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.42 1.488 . . . . 0.0 111.989 171.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.7 p -153.16 137.72 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.565 -171.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.4 t -72.35 166.14 23.1 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 122.515 0.326 . . . . 0.0 110.17 175.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.81 -50.13 63.59 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.467 0.707 . . . . 0.0 112.204 -174.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -69.54 -35.95 75.92 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.741 -177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -64.71 -48.78 73.41 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.443 0.697 . . . . 0.0 110.505 175.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.4 -47.28 47.9 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.805 173.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -68.35 -42.41 79.28 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.981 0.513 . . . . 0.0 111.908 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -77.89 -60.69 2.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.133 0.573 . . . . 0.0 111.036 -170.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 40.4 t -75.45 -53.78 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.031 -176.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -94.57 -12.3 27.8 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -167.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 65.8 40.75 95.78 Favored Glycine 0 CA--C 1.529 0.922 0 O-C-N 123.359 0.412 . . . . 0.0 113.934 177.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.99 136.92 38.74 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.46 0.704 . . . . 0.0 110.28 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' HG12 ' A' ' 32' ' ' ILE . 64.4 p -80.54 160.19 25.26 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.578 0.751 . . . . 0.0 110.975 -173.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.24 -27.53 69.11 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.208 0.603 . . . . 0.0 112.488 -173.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 -77.66 -31.15 52.43 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.151 0.581 . . . . 0.0 109.551 174.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.39 -23.46 50.7 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.474 0.71 . . . . 0.0 109.875 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 28' ' ' SER . 35.8 mm -80.0 -59.43 2.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.738 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -176.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -47.93 -42.84 28.28 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -56.79 -56.55 20.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.913 0.485 . . . . 0.0 111.836 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.19 -33.21 65.27 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.862 -173.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -62.37 -51.45 67.56 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.839 0.856 . . . . 0.0 109.582 173.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 38.1 ttpt -61.5 -32.88 72.92 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.103 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.06 -37.99 53.48 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 -175.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 95.7 m -67.42 -51.45 51.6 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.942 176.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.514 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 17.8 mm -61.62 -59.34 4.46 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.004 0 C-N-CA 123.524 0.73 . . . . 0.0 110.764 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.565 ' HG ' HG13 ' A' ' 87' ' ' VAL . 0.1 OUTLIER -54.81 -33.55 61.7 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.141 0.976 . . . . 0.0 112.182 -177.502 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -77.53 -40.79 41.46 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.584 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 87.6 m -62.23 -37.48 85.53 Favored 'General case' 0 C--O 1.203 -1.384 0 C-N-CA 123.752 0.821 . . . . 0.0 110.361 176.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 93.4 mt -62.07 -27.34 68.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.863 0.865 . . . . 0.0 111.506 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HB2' HG21 ' A' ' 87' ' ' VAL . 37.9 ttt180 -92.14 -48.92 6.46 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 122.915 0.486 . . . . 0.0 110.395 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 49.9 mt -64.63 -24.4 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 C-N-CA 123.128 0.571 . . . . 0.0 111.71 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.584 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -55.52 -44.38 76.61 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.57 1.148 . . . . 0.0 110.701 -175.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' ARG . 11.9 ptp180 -63.91 -42.47 97.4 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.462 177.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.17 -36.28 77.24 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.513 0.725 . . . . 0.0 110.983 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -69.18 -36.25 77.15 Favored 'General case' 0 C--N 1.35 0.625 0 C-N-CA 123.676 0.79 . . . . 0.0 111.223 178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 26.6 mtp180 -77.4 -27.54 52.42 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.952 0.501 . . . . 0.0 111.0 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.552 ' HA ' ' SG ' ' A' ' 55' ' ' CYS . 95.7 mt -74.89 -48.16 26.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.824 0.449 . . . . 0.0 110.114 177.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -67.12 -20.49 65.78 Favored 'General case' 0 N--CA 1.486 1.33 0 O-C-N 122.389 -0.194 . . . . 0.0 110.861 176.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.81 70.54 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.439 0.696 . . . . 0.0 110.935 171.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 52' ' ' LEU . 29.0 p -97.11 10.25 39.88 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.276 0.631 . . . . 0.0 111.588 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -65.41 -23.36 66.93 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.874 0.87 . . . . 0.0 111.799 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.404 ' CE2' HG23 ' A' ' 58' ' ' THR . 27.3 p-90 -63.69 -23.83 67.53 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.528 0.731 . . . . 0.0 111.994 -178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.529 ' HA ' HG11 ' A' ' 63' ' ' VAL . 38.2 p -92.63 -15.97 26.17 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.967 0.507 . . . . 0.0 111.668 177.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 57.4 mm-40 -89.61 -19.25 25.15 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.029 0.532 . . . . 0.0 111.495 -174.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 26.5 m -67.85 149.66 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.981 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.781 169.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -76.53 -15.9 59.76 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.791 0.436 . . . . 0.0 111.592 -177.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -70.83 -35.09 72.32 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.269 0.628 . . . . 0.0 112.202 -176.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.1 p -61.42 134.51 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 122.821 0.448 . . . . 0.0 110.939 -175.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.6 t -100.36 104.29 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 123.728 0.811 . . . . 0.0 109.05 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -142.8 168.02 20.69 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.501 1.12 . . . . 0.0 108.503 178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.2 p -73.82 167.97 20.36 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.447 0.299 . . . . 0.0 110.28 174.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.06 -47.9 81.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -53.01 -49.07 66.97 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.459 1.104 . . . . 0.0 112.496 175.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.8 mm-40 -60.92 -52.92 62.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.944 0.497 . . . . 0.0 111.003 -179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 86.6 mttt -64.15 -23.06 67.18 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.408 1.083 . . . . 0.0 111.665 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -82.0 -59.58 2.52 Favored 'General case' 0 C--O 1.209 -1.057 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 -177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 30.8 m -49.7 -37.1 27.57 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 125.48 1.512 . . . . 0.0 112.652 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -71.8 -39.16 70.06 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.145 0.578 . . . . 0.0 111.821 176.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.34 -26.34 60.08 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.385 0.674 . . . . 0.0 110.855 176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 9.0 mtpm? -85.02 -24.77 28.05 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 18.1 t80 -59.37 -44.42 92.73 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.608 0.763 . . . . 0.0 109.227 168.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 -63.54 -51.63 64.62 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.127 0.892 . . . . 0.0 110.637 -179.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -66.11 -32.7 74.31 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.856 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.75 -31.84 57.35 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.101 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.9 tt -69.29 -48.58 61.26 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 -176.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -69.08 -26.46 64.95 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.462 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -65.08 -48.78 72.52 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.793 0.837 . . . . 0.0 110.409 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 95' ' ' TRP . 9.8 mp -72.44 132.88 83.41 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.86 129.5 22.24 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.912 2.408 . . . . 0.0 114.904 -161.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -68.41 85.74 0.28 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 160.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.439 ' H ' HG22 ' A' ' 93' ' ' ILE . 23.7 m -67.06 82.59 0.12 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.981 0.896 . . . . 0.0 111.415 -172.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.574 HG21 ' HB2' ' A' ' 45' ' ' ARG . 61.3 t -114.97 -20.6 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 113.831 -1.531 . . . . 0.0 107.879 176.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 24.6 m -48.08 -40.19 22.51 Favored 'General case' 0 C--N 1.364 1.224 0 C-N-CA 124.662 1.185 . . . . 0.0 110.757 170.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -138.85 150.45 46.02 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.896 171.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD22 ' HG3' ' A' ' 37' ' ' LYS . 23.6 tp -74.43 91.03 2.21 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HB2' HG21 ' A' ' 86' ' ' THR . 72.9 m -147.08 159.5 43.52 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.264 1.026 . . . . 0.0 109.524 178.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -61.89 143.07 56.96 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.826 0.85 . . . . 0.0 112.06 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.45 HG13 HD22 ' A' ' 44' ' ' LEU . 1.7 pp -94.42 132.51 38.26 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.614 0.766 . . . . 0.0 110.914 -178.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.75 126.17 72.35 Favored 'Isoleucine or valine' 0 C--N 1.348 0.522 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.543 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -141.37 164.15 37.08 Favored Pre-proline 0 C--O 1.242 0.669 0 C-N-CA 125.253 1.421 . . . . 0.0 108.449 173.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 80' ' ' LEU . 30.2 Cg_endo -59.49 149.04 84.32 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.228 1.952 . . . . 0.0 112.959 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -79.54 145.85 32.95 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.34 166.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 pp -70.45 151.86 95.55 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 119.112 -0.471 . . . . 0.0 110.453 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -54.93 -27.19 52.63 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 123.688 2.926 . . . . 0.0 114.421 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.6 t . . . . . 0 C--O 1.253 1.242 0 C-N-CA 123.156 0.582 . . . . 0.0 109.539 179.451 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.413 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.6 tmt? . . . . . 0 N--CA 1.485 1.304 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -124.31 151.98 43.64 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.152 0.981 . . . . 0.0 109.774 173.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 23.5 mt -68.13 102.16 1.29 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.196 0.598 . . . . 0.0 109.724 176.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -46.17 -28.36 1.22 Allowed 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 172.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.0 t -165.58 102.12 0.7 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 122.695 0.398 . . . . 0.0 110.799 177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.9 p -99.79 148.38 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 172.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -102.87 102.69 12.81 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 174.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.583 HG22 ' HB2' ' A' ' 27' ' ' ALA . 62.3 p -92.44 160.75 34.22 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 123.57 0.748 . . . . 0.0 109.193 176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.27 -24.6 51.89 Favored 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.587 2.191 . . . . 0.0 113.25 174.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -95.9 14.96 21.76 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.77 0.828 . . . . 0.0 112.641 -177.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.71 -174.6 17.61 Favored Glycine 0 N--CA 1.476 1.352 0 C-N-CA 122.734 0.207 . . . . 0.0 113.143 176.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -93.16 138.47 31.55 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 30.5 mm -125.17 123.0 64.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.182 0.993 . . . . 0.0 108.706 -174.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -96.2 126.68 41.59 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.567 0.747 . . . . 0.0 110.86 -178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 64.1 80.47 0.23 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.507 1.523 . . . . 0.0 111.467 172.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.57 137.97 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.527 1.131 . . . . 0.0 108.72 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.5 m -69.26 147.74 50.78 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 174.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.567 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -57.61 -36.51 71.86 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.667 0.787 . . . . 0.0 112.471 178.406 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.78 -42.38 95.12 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.554 0.533 . . . . 0.0 111.171 177.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -68.44 -42.06 79.41 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.718 0.407 . . . . 0.0 110.456 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.04 -37.66 34.17 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.987 0.915 . . . . 0.0 111.303 171.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLU . 81.6 mtp180 -71.92 -50.06 32.38 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.631 0.772 . . . . 0.0 111.803 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -75.84 -59.16 2.88 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.019 0.527 . . . . 0.0 111.492 -168.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.5 t -76.62 -51.51 19.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.359 0.664 . . . . 0.0 111.278 -175.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 8' ' ' THR . 86.4 m-85 -91.75 -29.81 16.6 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.085 -167.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.96 54.64 20.44 Favored Glycine 0 C--N 1.346 1.116 0 O-C-N 123.582 0.551 . . . . 0.0 112.741 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.583 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -76.77 157.0 31.93 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.095 0.958 . . . . 0.0 110.185 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -75.43 143.39 42.71 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.252 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -27.73 69.41 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 123.601 0.76 . . . . 0.0 110.416 178.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -76.07 -36.49 58.98 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.185 0.994 . . . . 0.0 110.281 174.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.65 -22.31 58.96 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.645 0.778 . . . . 0.0 110.803 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 18' ' ' GLU . 61.1 mt -81.31 -52.02 14.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.514 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 -178.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.86 -47.25 11.12 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.268 1.027 . . . . 0.0 112.958 167.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.15 -52.34 65.71 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.697 0.799 . . . . 0.0 111.809 176.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.17 -29.53 67.56 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.869 -178.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.3 ttp180 -70.93 -46.33 62.63 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.817 0.847 . . . . 0.0 109.276 178.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -55.78 -40.42 72.64 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.492 1.12 . . . . 0.0 110.936 172.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -79.77 -39.95 29.82 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.272 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.1 m -68.21 -47.09 68.8 Favored 'General case' 0 C--N 1.359 1.011 0 C-N-CA 123.374 0.669 . . . . 0.0 109.533 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.0 mm -63.1 -50.89 77.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 O-C-N 123.648 0.592 . . . . 0.0 110.28 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -31.83 57.95 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.053 0.941 . . . . 0.0 111.875 177.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -80.19 -41.43 25.26 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.584 0.754 . . . . 0.0 109.55 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.8 m -61.44 -39.95 92.68 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 125.674 1.589 . . . . 0.0 111.902 -177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 18.2 mt -62.93 -32.08 73.3 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.874 0.47 . . . . 0.0 110.549 -177.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 -86.94 -32.34 20.18 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.953 0.901 . . . . 0.0 111.511 -177.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -80.28 -59.91 2.6 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 122.953 0.501 . . . . 0.0 111.521 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 30.1 mm-40 -52.87 -44.26 66.7 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.085 0.954 . . . . 0.0 112.912 -170.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.62 -43.47 80.26 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.072 0.857 . . . . 0.0 111.282 176.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HA ' HD12 ' A' ' 52' ' ' LEU . 19.3 t70 -80.55 -26.79 37.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.254 0.622 . . . . 0.0 110.906 -173.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -67.39 -38.5 84.8 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.508 0.723 . . . . 0.0 111.254 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.57 ' HG3' HD13 ' A' ' 80' ' ' LEU . 15.7 ptp180 -82.81 -24.62 33.27 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.872 176.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 49' ' ' ASP . 35.4 mt -61.66 -50.77 71.16 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.442 0.697 . . . . 0.0 110.458 170.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -72.34 -28.94 63.36 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.756 -179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.88 -22.51 60.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.016 0.526 . . . . 0.0 111.521 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 36.0 t -83.04 -24.12 32.92 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.613 0.765 . . . . 0.0 111.156 176.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -62.59 -22.77 66.62 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.461 1.104 . . . . 0.0 113.897 -166.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.7 p-90 -59.31 -32.45 70.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.907 0.483 . . . . 0.0 111.769 179.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.493 ' HA ' HG11 ' A' ' 63' ' ' VAL . 75.9 p -78.91 -35.31 43.66 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.542 0.737 . . . . 0.0 110.547 178.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -68.15 -31.63 71.32 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 114.884 -1.053 . . . . 0.0 111.291 -176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 11.5 p -84.61 143.0 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 172.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 49.1 tp60 -72.11 -2.15 17.47 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.667 1.187 . . . . 0.0 112.209 -175.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -55.23 -37.17 66.82 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.618 1.167 . . . . 0.0 112.323 176.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.493 HG11 ' HA ' ' A' ' 58' ' ' THR . 7.7 p -92.61 152.43 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 122.683 0.393 . . . . 0.0 110.248 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 42.6 t -99.72 96.09 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 123.727 0.811 . . . . 0.0 109.299 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.423 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 79.2 mt -134.99 163.42 29.91 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 79.9 p -75.85 168.22 20.43 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 175.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.62 -43.06 93.93 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.885 173.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -48.98 -55.47 11.82 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 124.632 1.173 . . . . 0.0 111.585 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -62.37 -53.85 49.04 Favored 'General case' 0 N--CA 1.482 1.163 0 O-C-N 124.227 0.954 . . . . 0.0 110.569 -178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 80.2 mttt -63.33 -25.7 68.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.271 1.028 . . . . 0.0 112.555 -178.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -86.21 -43.84 12.66 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.073 0.549 . . . . 0.0 109.603 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 23.6 m -54.54 -37.51 65.49 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.362 0.665 . . . . 0.0 111.441 170.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -70.56 -35.64 73.21 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.25 0.62 . . . . 0.0 111.032 170.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.01 -29.23 68.99 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.971 0.508 . . . . 0.0 111.441 175.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -75.76 -39.0 57.88 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.509 ' OH ' ' HB2' ' A' ' 51' ' ' ARG . 21.5 t80 -56.98 -54.15 49.92 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 124.324 1.05 . . . . 0.0 110.305 178.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.526 ' HA ' HD12 ' A' ' 80' ' ' LEU . 28.2 ptt180 -67.96 -40.44 83.19 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 123.959 0.787 . . . . 0.0 110.726 -177.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -58.51 -40.7 83.56 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.891 0.876 . . . . 0.0 112.162 -178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.8 -29.73 69.75 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.561 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.57 HD13 ' HG3' ' A' ' 51' ' ' ARG . 33.5 mt -74.64 -56.89 4.32 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.067 0.947 . . . . 0.0 112.267 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 77' ' ' ARG . 14.1 ptm180 -66.73 -26.19 66.88 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.239 0.616 . . . . 0.0 111.964 -175.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -114.24 18.88 16.75 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.228 1.011 . . . . 0.0 111.638 -178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.1 pp -48.85 141.79 9.87 Favored Pre-proline 0 N--CA 1.496 1.83 0 C-N-CA 123.342 0.657 . . . . 0.0 112.44 -176.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.79 153.14 53.44 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 122.212 1.941 . . . . 0.0 111.685 -178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -61.82 91.75 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.432 1.093 . . . . 0.0 111.318 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.8 t -65.59 91.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.507 178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.9 m -62.0 136.32 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.853 -173.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . 0.275 6.7 t 57.66 -59.6 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 127.202 2.201 . . . . 0.0 114.674 -174.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -56.66 99.16 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.504 1.122 . . . . 0.0 111.532 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 23.8 tp -125.8 35.43 4.71 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-O 122.141 0.972 . . . . 0.0 109.789 -175.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 69.3 m -144.44 -50.6 0.28 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.756 0.822 . . . . 0.0 108.79 175.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 78.71 5.53 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-O 122.461 1.124 . . . . 0.0 109.01 175.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -82.78 105.48 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 114.275 -1.329 . . . . 0.0 109.625 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 67.9 t -94.88 101.53 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.458 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -130.93 154.06 81.89 Favored Pre-proline 0 C--O 1.244 0.792 0 C-N-CA 124.476 1.111 . . . . 0.0 108.784 179.462 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -59.86 139.78 89.87 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.366 2.044 . . . . 0.0 113.205 -174.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -87.18 156.74 19.56 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 164.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -51.37 141.86 21.86 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -173.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -66.01 -35.98 32.06 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.865 2.377 . . . . 0.0 113.527 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.9 t . . . . . 0 C--O 1.248 0.993 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 -177.147 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.425 ' HE1' HD12 ' A' ' 3' ' ' LEU . 1.3 tmt? . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.972 0.415 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 15' ' ' ASN . 2.5 pp -116.48 153.5 32.02 Favored 'General case' 0 C--O 1.247 0.927 0 C-N-CA 124.715 1.206 . . . . 0.0 108.705 172.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.487 HD11 ' HG3' ' A' ' 18' ' ' GLU . 6.4 mp -66.09 102.15 0.78 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 174.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.7 t60 -39.76 -36.17 0.4 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 125.345 1.458 . . . . 0.0 112.925 172.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.1 p -162.21 148.99 13.53 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.206 1.002 . . . . 0.0 109.843 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.5 p -156.55 139.36 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.709 0.804 . . . . 0.0 109.399 177.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -85.25 122.06 28.89 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.587 HG22 ' HB2' ' A' ' 27' ' ' ALA . 68.6 p -116.86 159.83 39.17 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.32 1.048 . . . . 0.0 108.509 175.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.3 -21.31 51.96 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 122.873 2.382 . . . . 0.0 113.59 175.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.511 ' HD3' ' HA ' ' A' ' 25' ' ' PHE . 16.2 ptm180 -96.1 8.49 43.65 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.521 0.728 . . . . 0.0 112.023 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 125.09 -162.25 19.42 Favored Glycine 0 N--CA 1.484 1.835 0 C-N-CA 122.913 0.292 . . . . 0.0 112.874 174.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -88.19 136.65 32.88 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mm -126.63 126.66 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 C-N-CA 124.045 0.938 . . . . 0.0 108.707 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.2 mt -105.42 156.87 17.78 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 124.074 0.95 . . . . 0.0 110.363 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.543 ' HA ' HD13 ' A' ' 2' ' ' LEU . 7.0 p30 39.52 82.31 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 126.717 2.007 . . . . 0.0 113.049 177.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.3 p -152.52 134.99 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.832 -173.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.5 t -70.86 158.5 36.3 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.809 0.443 . . . . 0.0 110.269 173.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' HG3' HD11 ' A' ' 3' ' ' LEU . 2.1 mp0 -56.11 -44.94 79.57 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.129 0.971 . . . . 0.0 110.974 -178.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -61.55 -46.61 89.18 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.139 0.899 . . . . 0.0 111.633 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -70.58 -46.56 63.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.872 0.469 . . . . 0.0 111.123 -178.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.02 -47.43 53.2 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.203 0.601 . . . . 0.0 111.557 174.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 79.9 mtp180 -66.97 -46.27 75.14 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 0.0 111.421 177.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -78.22 -63.64 1.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.935 0.494 . . . . 0.0 111.612 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.5 t -73.14 -55.16 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.249 1.019 . . . . 0.0 111.459 -177.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.511 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 66.9 m-85 -88.43 -13.21 41.01 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -169.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.58 45.16 87.24 Favored Glycine 0 C--N 1.344 1.022 0 O-C-N 123.245 0.341 . . . . 0.0 113.911 174.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.587 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -81.98 144.62 30.77 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 123.637 0.775 . . . . 0.0 109.902 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.42 ' O ' HG12 ' A' ' 32' ' ' ILE . 16.2 m -76.45 149.03 36.87 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.004 0.922 . . . . 0.0 109.419 -176.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.21 -25.39 67.68 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.556 0.342 . . . . 0.0 110.883 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -68.63 -38.23 80.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.384 0.673 . . . . 0.0 110.544 171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.55 -22.63 46.94 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.849 0.86 . . . . 0.0 110.65 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 27' ' ' ALA . 25.7 mm -82.7 -36.35 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -176.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -78.56 -46.57 19.13 Favored 'General case' 0 C--N 1.346 0.437 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.421 -174.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.44 -53.55 56.92 Favored 'General case' 0 C--N 1.351 0.632 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.585 176.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.58 -38.46 80.7 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -63.29 -51.35 66.43 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 176.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 34.4 ttpt -58.18 -35.01 70.95 Favored 'General case' 0 C--O 1.213 -0.835 0 O-C-N 124.201 0.938 . . . . 0.0 111.358 176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.83 -44.73 61.07 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 122.992 0.517 . . . . 0.0 110.162 -173.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.3 m -66.93 -46.18 75.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.789 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -60.72 -54.16 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 C-N-CA 123.996 0.918 . . . . 0.0 110.874 178.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -56.57 -33.89 66.59 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 124.555 1.142 . . . . 0.0 111.279 -178.52 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.473 ' HG2' HD11 ' A' ' 46' ' ' ILE . 41.2 tt0 -74.52 -45.01 48.59 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 177.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.9 m -58.5 -37.38 75.46 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 125.685 1.594 . . . . 0.0 111.574 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 28.2 mt -61.18 -25.35 66.97 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.5 0.72 . . . . 0.0 111.613 -176.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 49.0 ttp180 -97.23 -43.81 7.19 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 122.951 0.5 . . . . 0.0 110.482 177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.473 HD11 ' HG2' ' A' ' 42' ' ' GLN . 81.7 mt -58.16 -52.82 53.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 C-N-CA 123.838 0.855 . . . . 0.0 111.647 -175.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -51.81 -36.51 48.08 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 124.574 1.171 . . . . 0.0 112.621 -174.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.3 ttp180 -56.29 -57.7 11.14 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.172 0.92 . . . . 0.0 109.801 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -64.3 -34.02 77.17 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.158 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.01 -41.65 86.32 Favored 'General case' 0 C--N 1.347 0.48 0 O-C-N 124.105 0.878 . . . . 0.0 111.703 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.514 ' HG3' HD13 ' A' ' 80' ' ' LEU . 12.8 ptm180 -76.73 -23.05 53.06 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 119.367 -0.349 . . . . 0.0 111.732 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.1 mp -65.77 -57.08 8.84 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 166.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.0 ptm180 -72.68 -20.33 61.26 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.097 -170.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.15 -29.08 65.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.173 0.589 . . . . 0.0 110.655 175.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.614 ' HG ' ' HE2' ' A' ' 76' ' ' TYR . 63.4 m -97.75 25.79 5.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.734 0.813 . . . . 0.0 111.17 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -66.07 -29.98 70.41 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.051 0.54 . . . . 0.0 111.104 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.9 p-90 -63.1 -29.41 70.78 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.998 0.919 . . . . 0.0 111.247 -178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.467 ' HA ' HG11 ' A' ' 63' ' ' VAL . 77.2 p -82.52 -30.68 29.62 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 122.746 0.418 . . . . 0.0 110.814 176.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -77.6 -21.08 52.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.189 0.596 . . . . 0.0 112.004 -177.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.7 p -86.48 154.86 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 122.819 0.447 . . . . 0.0 110.19 175.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -71.66 -1.16 12.75 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.98 1.312 . . . . 0.0 112.94 177.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.83 -46.62 68.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.405 0.682 . . . . 0.0 112.111 -175.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.467 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -73.85 149.14 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 C-N-CA 122.871 0.468 . . . . 0.0 111.549 -175.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 46.2 t -104.44 85.67 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.201 1.0 . . . . 0.0 108.509 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.5 mt -115.62 156.1 26.45 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.733 0.813 . . . . 0.0 109.359 175.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 80.4 p -76.28 163.8 26.67 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 168.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.13 -44.25 87.7 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.406 0.282 . . . . 0.0 111.006 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -49.34 -44.3 44.47 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.348 1.059 . . . . 0.0 112.728 174.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -71.76 -58.85 3.11 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.85 0.719 . . . . 0.0 110.672 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -67.57 -26.59 66.37 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.506 1.522 . . . . 0.0 112.035 -166.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -81.99 -48.44 11.45 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 13.1 m -49.84 -34.19 19.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 123.972 0.795 . . . . 0.0 111.716 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -71.36 -41.64 69.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.75 0.82 . . . . 0.0 112.08 173.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.68 67.88 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.395 0.678 . . . . 0.0 111.56 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -79.4 -34.62 41.65 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.539 1.135 . . . . 0.0 109.807 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.614 ' HE2' ' HG ' ' A' ' 55' ' ' CYS . 22.0 t80 -55.27 -48.54 73.88 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.206 0.942 . . . . 0.0 109.641 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.2 ttp85 -63.8 -50.46 68.87 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.52 -179.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.407 ' O ' ' HB3' ' A' ' 81' ' ' ARG . 8.1 tp-100 -64.46 -32.6 74.29 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 112.802 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.63 63.86 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 122.833 0.453 . . . . 0.0 111.211 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.514 HD13 ' HG3' ' A' ' 51' ' ' ARG . 34.9 mt -66.02 -30.89 71.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.088 0.955 . . . . 0.0 111.467 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.407 ' HB3' ' O ' ' A' ' 78' ' ' GLN . 77.5 ttt180 -65.49 -29.72 70.41 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.322 1.049 . . . . 0.0 111.661 176.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.87 -31.47 72.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.583 0.753 . . . . 0.0 111.965 -177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 95' ' ' TRP . 7.1 mp -70.51 124.98 91.84 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-O 119.381 -0.343 . . . . 0.0 111.039 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.11 130.87 18.34 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.662 2.242 . . . . 0.0 111.815 175.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.23 -49.65 73.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.567 1.147 . . . . 0.0 110.281 178.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.9 p -84.19 76.85 10.05 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.496 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.3 p -74.75 104.35 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 CA-C-O 121.923 0.868 . . . . 0.0 110.066 -177.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 25.8 m -67.56 -38.3 83.91 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.256 1.022 . . . . 0.0 110.934 -177.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -78.57 154.65 30.18 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.321 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.0 tp -81.14 82.26 7.11 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 175.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 43.1 m -137.27 145.38 43.44 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.061 0.944 . . . . 0.0 109.879 -174.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -83.61 152.04 25.02 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.692 0.797 . . . . 0.0 110.013 176.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.5 pp -72.86 85.35 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-O 121.768 0.794 . . . . 0.0 111.191 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -93.77 96.48 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.477 ' HB2' HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -117.81 151.85 49.22 Favored Pre-proline 0 N--CA 1.472 0.643 0 C-N-CA 123.988 0.915 . . . . 0.0 110.486 -172.048 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -51.04 134.55 43.15 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.171 2.581 . . . . 0.0 113.389 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -87.79 151.66 22.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 169.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.47 150.34 97.72 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.565 0.746 . . . . 0.0 111.834 -176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.38 -45.12 28.35 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.886 2.391 . . . . 0.0 113.63 -177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 C--O 1.248 1.013 0 C-N-CA 123.342 0.657 . . . . 0.0 109.285 -176.957 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -135.63 156.93 48.08 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.988 0.915 . . . . 0.0 109.332 170.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 77.9 mt -58.8 160.77 5.41 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.72 0.808 . . . . 0.0 111.763 176.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 61.7 t-80 -114.69 -29.89 6.65 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.284 -176.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.7 t -157.14 137.4 12.81 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.669 1.188 . . . . 0.0 108.12 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.2 p -147.34 133.31 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 123.256 0.622 . . . . 0.0 110.52 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -83.78 131.13 34.93 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.515 0.726 . . . . 0.0 110.208 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.6 p -123.95 154.0 67.65 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.666 1.186 . . . . 0.0 109.478 -178.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -55.09 -25.61 46.25 Favored 'Trans proline' 0 C--N 1.372 1.802 0 C-N-CA 122.767 2.311 . . . . 0.0 113.798 173.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -89.67 -15.1 33.39 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.838 0.855 . . . . 0.0 112.63 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 158.18 -125.57 1.56 Allowed Glycine 0 C--N 1.35 1.311 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -139.68 146.72 40.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.4 mm -133.1 127.75 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -172.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -105.16 146.56 29.04 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.017 0.527 . . . . 0.0 110.791 -176.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.446 ' HA ' ' O ' ' A' ' 3' ' ' LEU . 76.8 m-20 51.54 68.09 0.85 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 125.263 1.425 . . . . 0.0 113.074 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.5 m -142.26 161.74 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.547 0.739 . . . . 0.0 110.132 -177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 48.2 t -68.56 149.82 48.75 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.719 0.407 . . . . 0.0 110.249 173.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.19 -34.89 75.8 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.031 0.532 . . . . 0.0 110.49 171.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -65.21 -46.75 79.42 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 114.78 -1.1 . . . . 0.0 109.64 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -70.38 -43.89 69.18 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.574 0.75 . . . . 0.0 110.749 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.426 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -47.12 -47.05 23.47 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.858 173.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -76.51 -35.36 58.37 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.877 0.471 . . . . 0.0 111.821 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -76.4 -62.03 1.75 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.308 0.643 . . . . 0.0 111.035 -169.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.0 t -80.08 -51.4 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 123.625 0.77 . . . . 0.0 110.755 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.426 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 49.8 m-85 -91.44 -13.22 32.68 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.71 -165.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 55.01 44.18 83.08 Favored Glycine 0 C--N 1.353 1.505 0 O-C-N 123.489 0.493 . . . . 0.0 112.75 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.487 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -66.3 153.77 41.73 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.037 0.935 . . . . 0.0 112.244 -169.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -67.0 124.73 23.85 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.349 176.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.74 -30.57 71.65 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.005 0.522 . . . . 0.0 109.968 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -56.89 -45.78 82.35 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.13 0.972 . . . . 0.0 110.825 172.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.76 -57.27 6.61 Favored 'General case' 0 C--O 1.212 -0.893 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.826 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.487 HD11 ' HB3' ' A' ' 27' ' ' ALA . 66.3 mt -45.42 -32.0 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 171.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.36 -55.79 5.93 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -58.01 -34.34 69.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 124.441 1.096 . . . . 0.0 112.158 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.15 -45.49 19.86 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.212 1.005 . . . . 0.0 110.475 -172.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -63.24 -48.24 79.07 Favored 'General case' 0 C--N 1.354 0.77 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 175.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -45.25 -49.29 12.58 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.969 0.908 . . . . 0.0 112.196 171.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.09 62.58 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.443 0.297 . . . . 0.0 110.661 -171.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 27.6 m -69.46 -46.11 67.48 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.77 0.828 . . . . 0.0 110.751 -177.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.486 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.4 mm -58.02 -60.41 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.582 0.753 . . . . 0.0 109.466 175.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.06 -32.97 56.24 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.843 1.257 . . . . 0.0 112.29 -176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -76.15 -46.33 29.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.508 0.723 . . . . 0.0 109.085 -179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 94.3 m -62.8 -33.27 74.86 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.642 1.177 . . . . 0.0 111.145 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 33.8 mt -64.63 -31.58 72.86 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.875 0.47 . . . . 0.0 110.92 -179.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -77.09 -48.99 16.29 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.897 174.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.5 mt -74.16 -22.13 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.666 0.786 . . . . 0.0 112.733 -171.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.4 OUTLIER -60.28 -40.22 89.63 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.012 0.925 . . . . 0.0 110.478 -173.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.8 ptp85 -64.07 -40.49 96.39 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.268 174.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -66.17 -30.01 70.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.009 0.524 . . . . 0.0 110.686 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -71.14 -39.47 71.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.796 0.839 . . . . 0.0 111.543 179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.0 ptp180 -81.5 -22.24 38.12 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.345 0.258 . . . . 0.0 111.45 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HD13 ' A' ' 80' ' ' LEU . 4.3 mp -65.42 -47.87 74.76 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -74.87 -24.54 58.58 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.093 0.557 . . . . 0.0 111.464 -178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.47 -47.85 45.54 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.129 0.572 . . . . 0.0 110.332 173.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.3 m -94.91 34.45 1.36 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.653 0.781 . . . . 0.0 109.991 177.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -88.22 -17.83 29.97 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.09 0.556 . . . . 0.0 110.551 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 64.6 p-90 -52.15 -36.23 50.83 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.456 0.702 . . . . 0.0 110.814 178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.606 ' HA ' HG11 ' A' ' 63' ' ' VAL . 2.7 t -86.97 -31.41 20.64 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.654 1.182 . . . . 0.0 111.609 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -83.61 -14.68 51.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.389 0.676 . . . . 0.0 112.042 -173.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.8 p -84.47 153.23 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 123.357 0.663 . . . . 0.0 109.374 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -72.23 -21.27 61.42 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.003 0.521 . . . . 0.0 111.933 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.87 -36.21 83.17 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.838 0.855 . . . . 0.0 112.761 -175.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 ' HA ' ' A' ' 58' ' ' THR . 10.8 p -69.56 144.23 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 36.9 t -102.41 84.66 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 -178.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.8 mt -121.47 162.61 20.18 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.791 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 71.8 p -77.62 157.77 30.09 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 175.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.8 -41.65 82.57 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 122.469 0.308 . . . . 0.0 110.427 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -57.79 -48.07 80.77 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.183 0.927 . . . . 0.0 111.904 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -62.39 -48.25 80.56 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-O 120.922 0.392 . . . . 0.0 110.771 176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.8 mttm -62.67 -24.31 67.57 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.878 1.271 . . . . 0.0 111.93 177.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -84.55 -46.36 11.65 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -176.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.1 m -51.82 -42.47 62.53 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.68 1.192 . . . . 0.0 110.849 171.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.424 ' CD2' HG21 ' A' ' 58' ' ' THR . 77.5 m95 -74.54 -30.69 61.86 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.658 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.08 61.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.298 0.639 . . . . 0.0 111.015 174.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.6 mttt -79.18 -33.58 43.83 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.585 0.754 . . . . 0.0 109.339 177.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.411 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 27.4 t80 -62.9 -53.44 54.12 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 123.888 0.742 . . . . 0.0 109.633 171.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.469 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 66.2 ttt-85 -64.4 -49.79 70.19 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.418 -174.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.03 -42.64 98.85 Favored 'General case' 0 C--N 1.354 0.784 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.015 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.33 91.2 Favored 'General case' 0 N--CA 1.482 1.134 0 O-C-N 123.442 0.464 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.473 HD13 HD12 ' A' ' 52' ' ' LEU . 19.8 mt -50.0 -66.44 0.39 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.207 1.003 . . . . 0.0 112.197 171.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -66.87 -24.52 66.14 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.198 0.599 . . . . 0.0 112.405 -172.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -76.32 -48.31 20.49 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.077 0.551 . . . . 0.0 111.047 -177.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.55 106.13 0.97 Allowed Pre-proline 0 N--CA 1.489 1.477 0 C-N-CA 123.942 0.897 . . . . 0.0 111.215 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -88.1 61.64 3.26 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.723 2.949 . . . . 0.0 111.164 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -24.44 66.41 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.273 1.029 . . . . 0.0 112.394 177.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.1 t -96.23 13.38 27.65 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.905 0.882 . . . . 0.0 110.744 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -123.07 130.56 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.434 1.094 . . . . 0.0 108.302 173.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 68.8 p 52.81 30.77 9.51 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 125.706 1.602 . . . . 0.0 113.86 176.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -145.61 158.04 43.9 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.903 0.481 . . . . 0.0 111.116 -176.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -143.94 8.72 1.48 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.595 0.758 . . . . 0.0 111.351 -175.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 77.6 p -75.2 -68.68 0.53 Allowed 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 -173.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -177.86 167.82 2.09 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.664 0.786 . . . . 0.0 111.478 177.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 23.0 pt -84.48 102.43 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.891 173.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -122.7 123.02 67.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 174.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.434 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -140.76 164.02 39.1 Favored Pre-proline 0 N--CA 1.471 0.585 0 C-N-CA 124.369 1.067 . . . . 0.0 108.89 178.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -61.26 155.84 49.23 Favored 'Trans proline' 0 C--N 1.384 2.438 0 C-N-CA 122.085 1.857 . . . . 0.0 112.168 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -87.57 150.34 23.77 Favored 'General case' 0 C--O 1.246 0.919 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.75 140.7 28.05 Favored Pre-proline 0 CA--C 1.556 1.19 0 O-C-N 123.833 0.708 . . . . 0.0 111.936 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.411 ' HD3' ' HB2' ' A' ' 76' ' ' TYR . 45.2 Cg_endo -65.36 -35.73 38.58 Favored 'Trans proline' 0 C--N 1.368 1.56 0 C-N-CA 122.961 2.44 . . . . 0.0 113.281 -174.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -177.493 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.941 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 pp -130.1 148.33 51.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.14 0.976 . . . . 0.0 109.04 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -69.3 103.34 1.94 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.52 0.728 . . . . 0.0 110.271 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -48.28 -28.14 2.92 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.975 0.91 . . . . 0.0 112.966 168.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.8 p -154.03 144.27 22.13 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.972 0.909 . . . . 0.0 109.531 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -153.34 137.78 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 123.593 0.757 . . . . 0.0 109.247 175.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -82.69 139.18 33.82 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 174.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.6 p -126.01 159.27 62.74 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 124.458 1.103 . . . . 0.0 108.728 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.67 -23.24 63.68 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.223 1.949 . . . . 0.0 111.883 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -86.94 -0.5 56.66 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.091 0.956 . . . . 0.0 112.474 177.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 139.23 -118.75 1.58 Allowed Glycine 0 N--CA 1.477 1.415 0 C-N-CA 122.98 0.324 . . . . 0.0 112.512 175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -140.35 149.49 42.78 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 170.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 31.4 mm -133.04 137.99 52.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 124.424 1.089 . . . . 0.0 108.142 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.34 153.24 23.53 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.538 0.735 . . . . 0.0 110.361 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 51.08 59.52 4.56 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.555 1.542 . . . . 0.0 112.847 171.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 m -131.1 145.13 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.711 175.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.8 t -76.38 152.91 36.15 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -56.9 -24.7 53.99 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.55 0.74 . . . . 0.0 112.128 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -64.07 -60.06 3.7 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.74 0.816 . . . . 0.0 110.655 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -68.72 -38.05 79.93 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.55 -177.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -47.05 -52.54 14.75 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.017 0.823 . . . . 0.0 111.659 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.5 mtm180 -74.97 -31.93 61.57 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.588 0.355 . . . . 0.0 111.957 178.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -76.75 -62.57 1.59 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.351 0.26 . . . . 0.0 111.574 -169.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.3 t -85.2 -49.37 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 123.434 0.694 . . . . 0.0 110.683 -175.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -86.58 -20.32 28.09 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.337 -170.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.7 46.15 93.78 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.714 0.634 . . . . 0.0 112.204 -177.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -69.29 140.39 54.39 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.048 0.939 . . . . 0.0 111.165 -175.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.5 t -60.9 131.28 50.16 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 32' ' ' ILE . 35.5 mt-10 -74.0 -20.5 60.31 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.581 0.352 . . . . 0.0 110.137 -179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -56.18 -47.96 77.29 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.608 0.763 . . . . 0.0 110.138 165.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.55 -56.67 6.68 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.138 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 29' ' ' GLU . 95.0 mt -45.34 -29.65 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 169.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.41 -51.67 11.38 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 178.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -57.14 -35.52 69.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.574 1.15 . . . . 0.0 112.014 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.17 -37.67 37.78 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.181 0.992 . . . . 0.0 110.239 -175.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.4 ttm180 -62.27 -51.59 67.09 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -50.01 -43.92 50.88 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.619 1.199 . . . . 0.0 111.946 174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.7 -37.91 26.65 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.021 0.529 . . . . 0.0 110.869 -170.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.8 m -68.49 -46.95 68.3 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.538 0.735 . . . . 0.0 109.352 178.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 23.9 mm -62.23 -46.12 97.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 123.964 0.79 . . . . 0.0 110.144 176.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.82 -37.33 59.84 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.795 0.838 . . . . 0.0 111.237 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -75.18 -40.82 59.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.588 0.755 . . . . 0.0 109.108 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.9 m -65.27 -33.13 75.25 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.807 1.243 . . . . 0.0 111.197 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 22.9 mt -60.56 -34.36 74.04 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 121.467 0.651 . . . . 0.0 110.072 179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -85.04 -36.92 20.92 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.841 178.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.42 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 28.3 mt -65.61 -54.01 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.78 -177.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -50.18 -48.37 54.12 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 124.159 0.912 . . . . 0.0 112.309 -175.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 32.3 ptt180 -62.88 -49.59 74.23 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.879 0.737 . . . . 0.0 110.608 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 48' ' ' ARG . 2.4 m-20 -65.32 -34.93 79.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.642 0.777 . . . . 0.0 110.877 -174.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 45.5 mm-40 -61.14 -55.94 26.59 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.076 0.951 . . . . 0.0 111.031 178.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -72.23 -24.53 61.4 Favored 'General case' 0 CA--C 1.551 1.006 0 O-C-N 123.631 0.582 . . . . 0.0 112.346 -174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.616 HD22 ' HG3' ' A' ' 77' ' ' ARG . 96.4 mt -69.84 -46.45 65.56 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.832 0.453 . . . . 0.0 110.196 173.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -79.13 -21.88 45.95 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 122.732 0.413 . . . . 0.0 111.45 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.18 -23.64 60.45 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.392 0.677 . . . . 0.0 110.725 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' SG ' ' HZ3' ' A' ' 73' ' ' TRP . 68.5 m -108.67 13.61 25.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.25 1.02 . . . . 0.0 111.39 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -75.03 -20.48 59.57 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.696 0.798 . . . . 0.0 111.1 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.0 p-90 -60.58 -23.59 64.78 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.831 0.852 . . . . 0.0 111.938 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.532 ' HA ' HG11 ' A' ' 63' ' ' VAL . 82.7 p -83.73 -28.01 28.55 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.549 0.74 . . . . 0.0 111.398 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -84.77 -25.83 27.97 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.408 1.083 . . . . 0.0 111.454 -171.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 9.4 p -68.11 147.44 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.174 0 C-N-CA 122.898 0.479 . . . . 0.0 109.925 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -74.0 -10.28 59.48 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.49 0.716 . . . . 0.0 112.752 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.16 -52.07 57.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.17 0.588 . . . . 0.0 111.556 178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.532 HG11 ' HA ' ' A' ' 58' ' ' THR . 11.2 p -62.45 139.91 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 123.927 0.767 . . . . 0.0 111.269 -173.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -96.98 88.49 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 69.7 mt -128.09 156.01 43.49 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 69' ' ' GLN . 56.8 p -73.56 163.86 27.44 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 176.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.28 -44.74 65.14 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.488 0.715 . . . . 0.0 110.561 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -50.37 -55.94 13.51 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 124.676 1.235 . . . . 0.0 112.16 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.413 ' HG3' ' OG1' ' A' ' 66' ' ' THR . 69.6 mt-30 -63.78 -48.71 75.85 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 123.741 0.65 . . . . 0.0 110.876 -173.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -60.78 -26.36 67.2 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.726 1.21 . . . . 0.0 112.681 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.68 -47.82 10.09 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 -177.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 32.3 m -49.9 -43.92 49.84 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 110.904 171.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.422 ' HZ3' ' SG ' ' A' ' 55' ' ' CYS . 64.4 m95 -70.41 -36.67 74.18 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.937 175.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.74 -27.13 64.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.222 0.609 . . . . 0.0 111.291 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -83.46 -29.05 28.34 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.32 0.648 . . . . 0.0 109.636 179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -60.26 -55.79 29.43 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.333 0.653 . . . . 0.0 110.01 169.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.616 ' HG3' HD22 ' A' ' 52' ' ' LEU . 36.9 ttp180 -64.16 -49.63 71.35 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.808 -175.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -63.8 -34.55 78.16 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.94 -40.66 98.32 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.512 . . . . 0.0 110.647 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.4 tt -67.95 -42.1 81.48 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.055 178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -71.83 -23.13 61.49 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.398 0.679 . . . . 0.0 111.276 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.97 -25.96 64.8 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.337 1.055 . . . . 0.0 110.784 176.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.4 mt -63.66 132.93 95.35 Favored Pre-proline 0 N--CA 1.481 1.083 0 C-N-CA 123.515 0.726 . . . . 0.0 110.311 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -64.24 158.0 50.89 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.02 2.48 . . . . 0.0 112.72 -179.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.26 172.22 6.91 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.809 0.844 . . . . 0.0 110.88 -171.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.3 p 55.24 9.69 0.37 Allowed 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 125.593 1.557 . . . . 0.0 114.764 171.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -91.67 125.53 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.783 0.833 . . . . 0.0 109.966 -172.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 44.8 p -88.18 84.8 6.88 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.533 0.733 . . . . 0.0 110.228 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -68.6 -43.39 76.54 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.707 0.803 . . . . 0.0 110.489 -178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 53.95 36.82 25.3 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 125.466 1.506 . . . . 0.0 110.594 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 39.7 m -139.14 -63.44 0.52 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.603 0.761 . . . . 0.0 109.032 -176.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -172.52 111.13 0.24 Allowed 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.77 0.828 . . . . 0.0 109.917 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.38 87.29 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 CA-C-O 121.704 0.764 . . . . 0.0 109.608 165.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.3 p -109.52 131.39 60.52 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.635 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 -175.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -138.14 164.14 42.67 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 124.009 0.924 . . . . 0.0 109.21 -175.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -55.21 140.67 81.33 Favored 'Trans proline' 0 C--N 1.384 2.427 0 C-N-CA 122.559 2.173 . . . . 0.0 111.784 175.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -93.99 150.71 20.1 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 174.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.46 141.37 63.36 Favored Pre-proline 0 CA--C 1.561 1.398 0 C-N-CA 123.044 0.537 . . . . 0.0 112.44 -176.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.4 -35.98 47.04 Favored 'Trans proline' 0 C--N 1.372 1.812 0 C-N-CA 123.006 2.47 . . . . 0.0 113.309 -177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 CA--C 1.553 1.068 0 C-N-CA 123.256 0.622 . . . . 0.0 109.394 -177.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.531 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.483 1.176 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 pp -120.13 153.75 35.72 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 125.001 1.32 . . . . 0.0 107.878 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mp -69.66 125.11 25.73 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.631 0.772 . . . . 0.0 109.585 178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -80.69 -18.83 46.69 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.7 t -155.68 138.13 14.95 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 125.421 1.488 . . . . 0.0 107.62 170.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.1 p -135.47 117.57 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.745 0.818 . . . . 0.0 109.863 178.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.91 101.21 6.72 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 173.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.672 HG22 ' HB2' ' A' ' 27' ' ' ALA . 18.9 p -97.13 158.78 32.73 Favored Pre-proline 0 CA--C 1.552 1.04 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 52.5 Cg_exo -56.36 -11.24 5.91 Favored 'Trans proline' 0 C--N 1.39 2.717 0 C-N-CA 123.603 2.868 . . . . 0.0 114.751 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -98.56 -34.72 10.48 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.012 0.525 . . . . 0.0 110.302 175.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 163.43 174.75 33.67 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.7 -0.56 . . . . 0.0 111.7 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -71.11 128.84 37.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.813 0.445 . . . . 0.0 109.882 179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 22.0 mm -128.67 128.55 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.16 153.0 22.37 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 111.733 -176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 p30 43.85 74.28 0.12 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 126.475 1.91 . . . . 0.0 113.689 175.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.1 t -131.01 143.45 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.025 -177.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 34.3 t -77.21 151.22 35.3 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.227 0.611 . . . . 0.0 110.005 172.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.15 -38.4 76.51 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.68 0.792 . . . . 0.0 112.573 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -69.41 -49.59 53.82 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 119.426 -0.321 . . . . 0.0 110.375 177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -50.14 75.17 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.512 0.725 . . . . 0.0 111.256 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.33 -53.85 15.95 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.924 0.89 . . . . 0.0 112.532 172.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 -67.69 -36.65 81.06 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -79.27 -63.83 1.33 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.711 0.804 . . . . 0.0 111.232 -171.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 74.9 t -78.87 -62.72 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 124.145 0.978 . . . . 0.0 110.697 -176.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -76.51 -9.87 58.97 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.343 -171.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 71.03 18.23 76.23 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 114.555 0.582 . . . . 0.0 114.555 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.672 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -56.28 121.29 9.17 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.404 0.681 . . . . 0.0 110.54 176.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.412 ' O ' HG12 ' A' ' 32' ' ' ILE . 87.8 p -61.71 164.81 5.71 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 123.639 0.587 . . . . 0.0 110.372 177.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -74.45 -23.66 58.94 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 -178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -73.05 -36.44 66.9 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.794 0.837 . . . . 0.0 111.165 170.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.68 -50.74 61.9 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 176.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 28' ' ' SER . 43.9 mm -49.19 -56.15 3.06 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.591 0 CA-C-O 118.53 -0.748 . . . . 0.0 112.209 169.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -44.99 -54.01 7.06 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.41 0.684 . . . . 0.0 112.555 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.47 -57.29 12.96 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.7 0.8 . . . . 0.0 112.971 175.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.93 -23.62 64.18 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.221 1.008 . . . . 0.0 113.556 -175.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.0 ttt180 -74.86 -47.45 30.15 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 176.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 41' ' ' LEU . 26.4 ttpt -57.6 -38.46 74.94 Favored 'General case' 0 C--O 1.207 -1.154 0 CA-C-N 115.168 -0.923 . . . . 0.0 110.182 170.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.82 -43.14 72.62 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -173.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -70.48 -45.39 65.79 Favored 'General case' 0 C--O 1.203 -1.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.675 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.531 HD11 ' HG3' ' A' ' 1' ' ' MET . 17.2 mm -61.06 -58.38 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.426 0.69 . . . . 0.0 111.285 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 37' ' ' LYS . 0.1 OUTLIER -53.12 -38.19 62.44 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.169 1.387 . . . . 0.0 111.754 -178.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -78.06 -51.76 9.8 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.666 0.386 . . . . 0.0 110.36 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.9 m -56.54 -48.47 77.21 Favored 'General case' 0 C--O 1.204 -1.34 0 C-N-CA 124.805 1.242 . . . . 0.0 111.51 -176.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HB3' HG21 ' A' ' 93' ' ' ILE . 37.0 mt -68.41 -34.52 76.17 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.057 0.943 . . . . 0.0 111.439 -176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -64.12 -30.35 71.42 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 123.259 0.624 . . . . 0.0 111.223 172.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.6 mt -98.1 -22.36 4.92 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.953 0.901 . . . . 0.0 111.464 -176.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' HH12 ' A' ' 51' ' ' ARG . 14.7 mm-40 -60.12 -36.17 76.89 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.511 1.124 . . . . 0.0 111.75 -172.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' HD21 ' A' ' 80' ' ' LEU . 7.6 ptm180 -57.55 -42.99 84.09 Favored 'General case' 0 CA--C 1.555 1.144 0 O-C-N 124.304 1.003 . . . . 0.0 111.175 175.154 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.55 -33.12 64.54 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.766 0.827 . . . . 0.0 111.007 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -56.92 -51.69 68.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.966 0.906 . . . . 0.0 110.881 178.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 5.5 ptp85 -80.01 -23.51 41.45 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.161 -0.927 . . . . 0.0 112.399 -177.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mp -68.08 -37.55 81.38 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.748 0.419 . . . . 0.0 111.259 172.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.405 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 9.5 ptp85 -79.22 -24.77 42.88 Favored 'General case' 0 N--CA 1.483 1.216 0 CA-C-O 120.801 0.334 . . . . 0.0 110.12 174.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.544 ' HB3' ' HA ' ' A' ' 51' ' ' ARG . . . -76.41 1.6 15.93 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.194 0.598 . . . . 0.0 111.119 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 73' ' ' TRP . 42.1 t -124.55 17.15 8.87 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.566 1.146 . . . . 0.0 109.616 172.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.405 ' HB2' ' HA ' ' A' ' 53' ' ' ARG . 29.2 t70 -99.99 -37.14 9.13 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.095 0.558 . . . . 0.0 111.127 -176.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.9 p-90 -59.38 -26.41 65.08 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.541 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.0 p -80.6 -23.42 39.82 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.491 0.717 . . . . 0.0 111.797 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 31.0 mm-40 -79.91 -40.05 29.07 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.69 0.396 . . . . 0.0 111.01 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.7 m -66.35 154.21 8.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 O-C-N 123.604 0.565 . . . . 0.0 110.982 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -85.38 -5.71 59.28 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.1 0.56 . . . . 0.0 111.506 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.08 -43.15 95.69 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.444 1.098 . . . . 0.0 111.144 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -69.01 155.64 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.687 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -102.04 87.54 1.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 172.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.4 mt -136.7 159.56 41.47 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.867 1.267 . . . . 0.0 108.097 175.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 43.1 p -87.92 159.13 18.48 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.15 -42.29 69.4 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.881 0.472 . . . . 0.0 111.312 -179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -49.98 -55.73 13.47 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.394 1.078 . . . . 0.0 111.935 173.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -58.24 -50.99 71.61 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.144 0.903 . . . . 0.0 111.067 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -67.45 -26.78 66.56 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.71 1.204 . . . . 0.0 111.76 -175.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -82.99 -43.35 16.49 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.265 0.626 . . . . 0.0 109.84 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.9 m -50.78 -44.48 58.82 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.654 170.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.538 ' HZ2' ' HB ' ' A' ' 100' ' ' VAL . 80.1 m95 -67.07 -42.41 84.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 172.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.09 74.79 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.46 0.704 . . . . 0.0 112.134 -177.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -86.34 -20.57 28.12 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 122.915 0.486 . . . . 0.0 110.493 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -68.42 -52.0 37.66 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.831 0.853 . . . . 0.0 110.193 174.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -69.03 -40.59 78.52 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.418 -176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -65.07 -47.62 76.65 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.173 0.589 . . . . 0.0 111.117 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.84 -26.89 68.4 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.807 0.443 . . . . 0.0 111.68 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.419 HD21 ' HB2' ' A' ' 48' ' ' ARG . 10.6 tt -71.01 -42.98 68.87 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 176.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -61.15 -36.54 80.05 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.833 0.453 . . . . 0.0 110.676 175.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -86.93 14.62 7.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.217 1.007 . . . . 0.0 112.388 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 4.2 pp -61.44 141.54 94.42 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-N 118.205 0.457 . . . . 0.0 110.255 179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 25.2 Cg_exo -64.59 159.71 43.5 Favored 'Trans proline' 0 C--N 1.371 1.743 0 C-N-CA 123.003 2.469 . . . . 0.0 112.918 177.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -100.96 8.07 43.25 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.06 0.544 . . . . 0.0 110.324 173.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.7 p -71.24 91.02 0.93 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.962 0.905 . . . . 0.0 110.874 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t 60.62 68.8 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.25 1.02 . . . . 0.0 110.272 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 59.7 m -149.4 98.27 2.76 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.643 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.26 -166.67 1.33 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.354 0.662 . . . . 0.0 110.071 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.15 -30.77 70.59 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.084 0.953 . . . . 0.0 112.465 -175.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 32.8 t -107.4 152.85 23.63 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.461 0.704 . . . . 0.0 109.297 176.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 59.75 81.36 0.17 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.946 1.299 . . . . 0.0 110.113 -175.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.519 HG21 ' HB3' ' A' ' 44' ' ' LEU . 2.4 pp -86.01 157.1 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.773 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 7.6 p -141.19 112.51 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 122.996 0.518 . . . . 0.0 110.105 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -145.6 163.81 29.52 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 124.467 1.107 . . . . 0.0 109.16 173.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -63.48 146.39 92.97 Favored 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 121.815 1.677 . . . . 0.0 112.104 172.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -85.34 137.82 32.7 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 172.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.86 151.06 56.54 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.23 -37.29 32.34 Favored 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 122.747 2.298 . . . . 0.0 112.979 178.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.538 ' HB ' ' HZ2' ' A' ' 73' ' ' TRP . 34.6 t . . . . . 0 C--O 1.248 1.001 0 C-N-CA 123.996 0.918 . . . . 0.0 109.309 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 pp -128.31 150.5 50.04 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.594 0.758 . . . . 0.0 110.702 173.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.519 HD11 HG23 ' A' ' 32' ' ' ILE . 21.8 mt -72.06 100.57 2.54 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.919 0.887 . . . . 0.0 110.579 176.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.4 t60 -52.36 -20.99 3.13 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.4 p -159.19 134.12 8.15 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.456 0.702 . . . . 0.0 109.21 172.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 8.2 p -146.22 136.34 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 123.074 0.55 . . . . 0.0 110.635 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -78.22 125.34 29.21 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.813 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.1 p -121.89 159.19 52.37 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 124.747 1.219 . . . . 0.0 109.6 -178.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.1 -31.73 76.52 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.774 2.316 . . . . 0.0 112.548 172.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -86.83 -4.42 59.17 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.409 1.084 . . . . 0.0 113.05 -177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 141.63 -118.49 1.34 Allowed Glycine 0 C--N 1.347 1.155 0 N-CA-C 112.046 -0.421 . . . . 0.0 112.046 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -139.53 150.55 45.24 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.8 mm -124.69 122.23 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 84.0 mt -92.12 119.04 31.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.871 0.868 . . . . 0.0 109.982 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 66.68 89.03 0.1 Allowed 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.239 1.416 . . . . 0.0 111.059 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 8.2 p -152.84 141.77 14.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.137 -177.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.2 p -66.36 149.34 50.53 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 173.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -56.52 -27.84 58.43 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.866 0.466 . . . . 0.0 111.359 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -61.58 -59.81 4.64 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.199 1.0 . . . . 0.0 111.01 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -69.02 -37.74 78.8 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 123.714 0.634 . . . . 0.0 111.062 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.69 -50.04 35.06 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.5 0.72 . . . . 0.0 111.431 171.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -73.67 -41.3 62.86 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 178.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -77.41 -64.27 1.18 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.087 0.47 . . . . 0.0 111.187 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -78.65 -48.04 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.969 0.908 . . . . 0.0 110.998 -173.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -88.87 -23.16 22.84 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.248 -171.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 60.23 46.79 93.61 Favored Glycine 0 C--N 1.352 1.423 0 O-C-N 123.571 0.544 . . . . 0.0 112.08 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.537 ' HB3' HD11 ' A' ' 32' ' ' ILE . . . -67.03 153.78 42.81 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.168 0.987 . . . . 0.0 112.323 -169.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.8 m -62.43 122.06 14.8 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.345 -0.843 . . . . 0.0 108.822 172.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.47 -30.98 69.96 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.758 0.423 . . . . 0.0 111.019 -172.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -69.16 -31.09 69.5 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.705 0.802 . . . . 0.0 111.135 175.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -72.22 -50.74 25.13 Favored 'General case' 0 C--O 1.209 -1.046 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.537 HD11 ' HB3' ' A' ' 27' ' ' ALA . 72.6 mt -46.92 -31.97 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 166.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -75.91 -56.09 5.0 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -53.43 -49.69 66.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.614 1.165 . . . . 0.0 112.522 174.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.81 -34.62 77.1 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.078 0.951 . . . . 0.0 111.048 -175.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.2 ttm105 -61.84 -55.85 25.5 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -53.29 -42.26 66.43 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 124.643 1.214 . . . . 0.0 111.721 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -77.81 -37.74 47.96 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.115 0.566 . . . . 0.0 110.866 -170.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.1 m -73.15 -44.08 60.61 Favored 'General case' 0 C--N 1.356 0.853 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 -179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.504 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 27.8 mm -55.17 -59.06 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 171.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.87 -39.83 59.6 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.183 1.393 . . . . 0.0 112.87 -177.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -75.63 -43.27 48.74 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 73.5 m -61.41 -40.03 92.89 Favored 'General case' 0 C--O 1.2 -1.502 0 C-N-CA 124.222 1.009 . . . . 0.0 111.112 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.653 HD22 HG12 ' A' ' 93' ' ' ILE . 21.4 mt -64.6 -26.8 68.56 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-N 118.496 0.589 . . . . 0.0 111.723 -176.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -77.3 -53.4 7.74 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.319 175.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 50' ' ' GLU . 82.2 mt -63.59 -42.05 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.231 1.013 . . . . 0.0 112.363 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.46 -46.06 89.85 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 125.578 1.551 . . . . 0.0 109.539 -170.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 30.1 ttp85 -60.86 -45.28 95.15 Favored 'General case' 0 CA--C 1.551 1.01 0 CA-C-N 114.333 -1.303 . . . . 0.0 110.748 175.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -63.61 -36.44 83.81 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 122.881 0.472 . . . . 0.0 111.815 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 46' ' ' ILE . 19.3 mm-40 -68.66 -45.6 71.34 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.237 0.615 . . . . 0.0 111.045 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 10.7 ptp180 -71.14 -26.78 63.16 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.479 0.487 . . . . 0.0 111.635 179.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.2 mt -63.43 -57.75 9.27 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 171.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -72.03 -19.01 61.91 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.43 0.692 . . . . 0.0 111.234 -175.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -73.39 -21.0 60.61 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.229 0.612 . . . . 0.0 111.309 173.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 71.2 m -102.86 10.78 38.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.66 0.784 . . . . 0.0 111.739 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -58.76 -29.59 66.88 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.43 0.692 . . . . 0.0 111.469 176.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.409 ' CE2' HG23 ' A' ' 58' ' ' THR . 18.4 p-90 -64.13 -29.92 71.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.754 0.822 . . . . 0.0 112.158 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.409 HG23 ' CE2' ' A' ' 57' ' ' TRP . 41.9 p -86.13 -23.59 26.53 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.374 0.27 . . . . 0.0 111.218 176.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 55' ' ' CYS . 24.9 mm-40 -75.44 -34.05 60.93 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.249 0.62 . . . . 0.0 111.289 -177.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 28.3 m -66.17 -21.04 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 O-C-N 123.412 0.445 . . . . 0.0 110.893 173.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 51.81 19.69 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 126.763 2.025 . . . . 0.0 114.119 173.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -84.79 -29.6 25.29 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.632 0.773 . . . . 0.0 109.779 176.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.2 142.64 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.743 1.217 . . . . 0.0 110.3 171.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 60.7 t -84.85 89.51 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.385 0.612 . . . . 0.0 109.744 -173.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 87.5 mt -128.2 150.66 49.92 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 175.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 p -67.47 152.62 45.35 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.21 -40.6 64.6 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 120.938 0.399 . . . . 0.0 110.787 178.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -56.36 -47.48 78.76 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.611 172.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -63.16 -51.57 65.88 Favored 'General case' 0 N--CA 1.495 1.817 0 C-N-CA 123.017 0.527 . . . . 0.0 109.917 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 84.1 mttt -61.17 -25.4 67.0 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.979 1.312 . . . . 0.0 112.525 178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 75' ' ' LYS . . . -78.98 -44.74 21.72 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 -178.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 8.5 m -57.5 -40.07 77.87 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 114.405 -1.27 . . . . 0.0 111.086 173.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -71.07 -32.59 69.3 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.383 0.673 . . . . 0.0 111.526 174.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.72 -29.25 64.34 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.157 0.583 . . . . 0.0 110.5 176.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 71' ' ' ALA . 98.2 mttt -75.73 -31.42 59.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.649 0.78 . . . . 0.0 110.177 178.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -58.49 -50.7 72.78 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.105 0.878 . . . . 0.0 109.918 174.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.6 ttt180 -66.19 -52.19 50.47 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.894 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 9.8 tp-100 -52.66 -34.21 50.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.861 0.864 . . . . 0.0 113.093 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.505 ' HB3' ' HG3' ' A' ' 96' ' ' PRO . . . -72.4 -46.71 54.0 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 122.408 0.283 . . . . 0.0 110.848 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.55 -39.62 77.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.926 0.89 . . . . 0.0 112.874 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -79.14 -26.07 42.85 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.323 0.249 . . . . 0.0 111.02 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.41 -40.87 85.6 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.425 0.69 . . . . 0.0 111.002 -178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.43 115.48 18.48 Favored Pre-proline 0 N--CA 1.479 1.022 0 O-C-N 123.647 0.592 . . . . 0.0 110.551 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -81.78 86.1 1.62 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 C-N-CA 122.29 1.993 . . . . 0.0 110.274 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -64.02 -22.15 66.81 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.035 -1.439 . . . . 0.0 112.394 -171.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.0 p -78.06 98.4 5.74 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.623 0.769 . . . . 0.0 109.504 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 60.2 t 60.51 84.7 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 125.228 1.411 . . . . 0.0 111.221 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 11.0 t -127.73 167.36 16.59 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.061 0.944 . . . . 0.0 109.862 178.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.83 -3.99 58.9 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.15 0.58 . . . . 0.0 111.042 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.58 104.37 3.85 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 47.7 t -70.89 -44.6 65.96 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -100.85 141.09 34.22 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.044 0.937 . . . . 0.0 109.671 176.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.653 HG12 HD22 ' A' ' 44' ' ' LEU . 2.7 pp -76.19 121.57 28.51 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-O 121.224 0.535 . . . . 0.0 110.266 174.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.4 p -133.66 88.87 0.92 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 122.525 1.155 . . . . 0.0 108.336 170.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.423 ' CZ2' ' HB3' ' A' ' 47' ' ' GLU . 0.3 OUTLIER -110.37 157.41 38.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.284 178.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG3' ' HB3' ' A' ' 79' ' ' ALA . 38.7 Cg_endo -58.78 149.66 76.09 Favored 'Trans proline' 0 C--N 1.383 2.378 0 C-N-CA 122.747 2.298 . . . . 0.0 113.965 -166.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -91.73 138.33 31.65 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.7 pp -64.9 143.11 98.79 Favored Pre-proline 0 CA--C 1.547 0.832 0 O-C-N 123.718 0.636 . . . . 0.0 110.85 -177.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.22 -47.89 9.16 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 122.92 2.413 . . . . 0.0 114.449 -173.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.555 1.163 0 CA-C-O 118.749 -0.643 . . . . 0.0 109.737 -172.475 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.438 ' HG3' HD11 ' A' ' 40' ' ' ILE . 1.3 tmt? . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.5 pp -126.93 145.15 50.79 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.495 0.718 . . . . 0.0 109.517 174.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.478 HD23 ' HB3' ' A' ' 35' ' ' ALA . 5.9 mp -68.8 101.59 1.37 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.31 1.044 . . . . 0.0 110.301 -178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -45.65 -31.6 2.0 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.031 1.332 . . . . 0.0 113.099 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.1 t -155.97 129.56 8.37 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.524 HG21 HD13 ' A' ' 32' ' ' ILE . 14.8 p -134.58 141.91 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 123.605 0.762 . . . . 0.0 109.047 175.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -88.08 128.51 35.42 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.432 HG22 ' HB2' ' A' ' 27' ' ' ALA . 71.3 p -119.33 153.76 53.69 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 123.849 0.86 . . . . 0.0 109.474 -177.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -50.56 -31.3 31.03 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.994 2.463 . . . . 0.0 113.888 167.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -81.02 -16.74 52.49 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.013 0.525 . . . . 0.0 112.246 177.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 152.64 -111.13 0.48 Allowed Glycine 0 C--N 1.347 1.175 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 173.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -136.33 141.67 43.8 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.343 1.057 . . . . 0.0 108.406 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.2 mm -129.05 120.37 51.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.8 mt -97.6 123.58 41.54 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.194 0.998 . . . . 0.0 110.567 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 68.09 76.83 0.26 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.24 1.416 . . . . 0.0 111.059 173.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -147.55 141.48 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.933 0.493 . . . . 0.0 110.684 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.3 t -69.03 156.16 39.12 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.404 0.682 . . . . 0.0 111.27 177.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.9 -41.54 71.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.965 0.906 . . . . 0.0 111.876 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.2 tp60 -64.2 -57.86 8.28 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 123.651 0.595 . . . . 0.0 110.644 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.18 -45.12 95.91 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.599 0.76 . . . . 0.0 110.948 -177.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 25' ' ' PHE . . . -49.58 -57.33 7.32 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.363 0.665 . . . . 0.0 112.733 172.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -67.55 -37.66 83.01 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.233 0.613 . . . . 0.0 112.085 -177.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -79.16 -62.36 1.72 Allowed 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.478 0.711 . . . . 0.0 111.059 -172.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.0 t -77.19 -61.1 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.18 0.992 . . . . 0.0 111.398 -172.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.418 ' HD2' ' HA ' ' A' ' 21' ' ' ALA . 93.1 m-85 -70.9 -34.78 71.9 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.525 0.73 . . . . 0.0 110.734 -176.349 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.88 41.43 23.17 Favored Glycine 0 C--N 1.344 0.979 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -172.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.77 131.72 47.59 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.264 1.025 . . . . 0.0 110.328 177.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -55.25 131.83 46.37 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.591 1.182 . . . . 0.0 109.986 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -27.46 67.4 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.105 0.562 . . . . 0.0 110.909 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.18 -35.2 79.14 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.706 0.802 . . . . 0.0 111.054 172.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.09 33.66 Favored 'General case' 0 C--O 1.21 -0.994 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.524 HD13 HG21 ' A' ' 6' ' ' VAL . 50.2 mm -46.0 -33.69 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 163.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -74.49 -58.47 3.27 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.544 0.687 . . . . 0.0 109.555 -178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.2 -47.86 68.56 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.713 1.605 . . . . 0.0 113.005 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.478 ' HB3' HD23 ' A' ' 3' ' ' LEU . . . -80.76 -23.48 39.34 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.738 0.815 . . . . 0.0 112.14 -174.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.5 ttp180 -64.86 -52.75 54.91 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 168.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.585 ' HA ' HD21 ' A' ' 90' ' ' LEU . 23.0 ttpt -52.39 -42.83 64.35 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.088 174.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.76 -37.57 27.01 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 123.381 0.672 . . . . 0.0 110.819 -167.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.2 m -67.38 -44.1 79.74 Favored 'General case' 0 C--N 1.358 0.95 0 O-C-N 123.699 0.625 . . . . 0.0 109.942 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.569 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 26.6 mm -57.44 -60.15 2.44 Favored 'Isoleucine or valine' 0 C--N 1.354 0.777 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 174.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -51.77 -34.07 37.96 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 125.261 1.424 . . . . 0.0 112.647 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.7 -53.06 7.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.022 0.929 . . . . 0.0 109.521 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.486 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 55.1 m -58.68 -50.11 75.07 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.67 1.231 . . . . 0.0 110.8 -172.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' ILE . 36.2 mt -64.2 -50.16 69.16 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 124.346 1.029 . . . . 0.0 111.054 -175.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -64.0 -37.55 87.82 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.396 -176.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.04 -39.6 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 110.411 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.3 OUTLIER -59.77 -41.27 90.72 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.121 0.968 . . . . 0.0 110.903 -171.154 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.9 ttp85 -51.08 -51.29 54.77 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.231 1.012 . . . . 0.0 109.921 176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -67.96 -37.27 81.34 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.415 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -60.65 -36.71 79.37 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.633 0.773 . . . . 0.0 111.999 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 55.5 mtp85 -76.17 -36.33 58.76 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.109 0.564 . . . . 0.0 110.509 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 89.8 mt -62.14 -44.83 95.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.761 . . . . 0.0 110.722 176.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -78.68 -18.12 54.87 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 122.765 0.426 . . . . 0.0 111.378 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.96 -33.31 59.79 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.81 0.444 . . . . 0.0 111.113 176.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.4 p -92.42 15.88 13.04 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.418 0.687 . . . . 0.0 111.185 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -69.35 -25.2 64.07 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.259 0.624 . . . . 0.0 111.408 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 36.6 p-90 -64.06 -22.61 67.0 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.893 0.877 . . . . 0.0 111.897 -179.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 73' ' ' TRP . 63.8 p -85.92 -25.76 25.94 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.127 0.571 . . . . 0.0 110.286 178.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -83.48 -24.47 31.75 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.077 0.951 . . . . 0.0 111.366 -175.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.3 m -65.21 151.99 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-O 121.098 0.475 . . . . 0.0 111.646 -178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.41 -19.71 62.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.668 179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -72.86 -40.78 65.38 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.714 0.806 . . . . 0.0 112.312 -174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.7 p -70.3 139.41 20.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.025 0.53 . . . . 0.0 110.995 -173.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 3.8 p -101.46 89.03 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 122.273 1.035 . . . . 0.0 109.314 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.556 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 80.1 mt -120.26 158.77 26.32 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.04 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 75.7 p -75.01 169.14 18.59 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 174.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.7 -47.6 83.99 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.276 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -51.11 -51.41 53.74 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.986 0.914 . . . . 0.0 112.275 173.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -60.16 -55.56 32.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 123.736 0.647 . . . . 0.0 110.859 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.556 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.7 mttm -62.58 -25.13 67.92 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.95 0.9 . . . . 0.0 112.556 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -83.1 -49.38 9.58 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -176.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 16.6 m -55.54 -36.02 66.32 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 114.626 -1.17 . . . . 0.0 112.189 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.414 ' CD2' HG21 ' A' ' 58' ' ' THR . 73.4 m95 -76.24 -39.45 54.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.414 0.685 . . . . 0.0 111.567 176.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -22.74 65.37 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 122.908 0.483 . . . . 0.0 110.635 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -79.24 -38.44 35.57 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.15 0.98 . . . . 0.0 109.231 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -59.45 -45.49 91.46 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 123.79 0.681 . . . . 0.0 109.488 173.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.4 ttt85 -64.23 -46.25 84.62 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.052 178.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.0 tp-100 -60.0 -39.5 86.0 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.306 1.042 . . . . 0.0 112.929 178.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.5 -52.12 29.45 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.913 0.485 . . . . 0.0 110.516 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.411 HD21 ' HB2' ' A' ' 51' ' ' ARG . 35.4 tp -67.87 -30.82 70.27 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.738 0.815 . . . . 0.0 112.35 -177.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -79.94 -26.4 40.1 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 117.721 0.237 . . . . 0.0 110.476 177.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -59.04 -33.65 71.01 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.124 0.57 . . . . 0.0 110.193 174.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.42 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 58.7 mt -67.77 113.06 12.39 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 165.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 83' ' ' LEU . 9.1 Cg_exo -71.71 -177.81 2.71 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.05 2.5 . . . . 0.0 113.738 -168.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.15 47.16 1.37 Allowed 'General case' 0 N--CA 1.483 1.182 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.453 176.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.6 p -62.04 164.63 6.44 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.783 1.233 . . . . 0.0 111.25 -178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.1 t -55.82 -38.12 50.29 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 C-N-CA 123.233 0.613 . . . . 0.0 110.374 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.7 m 59.56 33.68 22.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 125.232 1.413 . . . . 0.0 110.483 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.04 102.52 1.32 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.076 -178.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.585 HD21 ' HA ' ' A' ' 37' ' ' LYS . 91.3 mt 62.66 13.85 6.68 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.038 1.335 . . . . 0.0 112.629 177.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.8 m -73.94 119.98 18.9 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.558 0.743 . . . . 0.0 111.1 -174.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -62.17 100.9 0.19 Allowed 'General case' 0 C--N 1.354 0.796 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 38.2 pt -71.03 107.12 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-O 121.687 0.755 . . . . 0.0 110.924 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.9 t -122.39 85.69 0.96 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 N-CA-C 106.025 -1.842 . . . . 0.0 106.025 170.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.459 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.6 OUTLIER -115.15 163.7 19.17 Favored Pre-proline 0 C--O 1.241 0.646 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.705 -179.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 19.7 Cg_endo -56.2 137.39 79.51 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 121.943 1.762 . . . . 0.0 112.967 -178.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -84.33 162.67 19.97 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 164.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.2 pp -53.05 136.78 47.82 Favored Pre-proline 0 CA--C 1.561 1.372 0 CA-C-N 117.518 0.145 . . . . 0.0 111.201 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.24 -40.01 6.72 Favored 'Trans proline' 0 C--N 1.367 1.536 0 C-N-CA 122.624 2.216 . . . . 0.0 113.101 -169.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.4 t . . . . . 0 C--O 1.25 1.097 0 C-N-CA 123.531 0.732 . . . . 0.0 109.784 -174.042 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ppp? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.984 0.421 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.6 pp -112.11 152.32 28.41 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.949 0.9 . . . . 0.0 108.658 172.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 mp -70.73 104.5 2.88 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.24 0.616 . . . . 0.0 110.239 177.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 23.8 t60 -45.3 -30.42 1.26 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.769 1.227 . . . . 0.0 112.812 169.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 p -161.43 143.75 12.01 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.675 0.79 . . . . 0.0 109.867 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.485 HG21 HD13 ' A' ' 32' ' ' ILE . 14.5 p -150.81 137.33 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 171.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -83.11 140.23 32.75 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.8 p -132.51 159.37 72.65 Favored Pre-proline 0 CA--C 1.547 0.865 0 C-N-CA 125.218 1.407 . . . . 0.0 108.231 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -65.15 -12.02 32.75 Favored 'Trans proline' 0 C--N 1.374 1.881 0 C-N-CA 122.352 2.034 . . . . 0.0 113.113 177.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptp85 -101.34 -4.15 27.53 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 148.82 -148.97 20.89 Favored Glycine 0 N--CA 1.476 1.355 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -119.74 143.75 47.63 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 171.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 47.3 mm -126.19 115.51 42.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.932 0.893 . . . . 0.0 108.741 -168.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 60.4 mt -98.48 153.37 18.66 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.884 0.874 . . . . 0.0 111.143 -174.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.2 p30 38.35 68.41 0.33 Allowed 'General case' 0 N--CA 1.496 1.849 0 C-N-CA 126.18 1.792 . . . . 0.0 113.223 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.6 p -134.99 143.72 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.3 -175.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.6 t -80.81 156.62 26.07 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.176 0.59 . . . . 0.0 110.074 174.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.93 -31.04 71.33 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.358 1.063 . . . . 0.0 112.918 -174.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -68.88 -57.82 5.01 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.266 0.353 . . . . 0.0 110.079 178.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -59.21 -46.87 87.29 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.992 0.808 . . . . 0.0 111.828 -177.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.39 -48.1 37.09 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.517 175.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.0 mtm180 -79.86 -33.09 40.39 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -78.02 -56.74 4.23 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.307 0.643 . . . . 0.0 110.947 -173.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -83.74 -61.76 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.111 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -80.8 -7.73 59.49 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.11 43.64 98.86 Favored Glycine 0 C--N 1.349 1.286 0 O-C-N 123.586 0.554 . . . . 0.0 114.043 174.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.37 140.54 41.44 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.167 0.587 . . . . 0.0 110.518 178.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.401 ' O ' HG12 ' A' ' 32' ' ' ILE . 44.1 t -68.58 142.66 55.11 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.62 0.768 . . . . 0.0 109.787 175.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.01 -23.78 65.04 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 123.63 0.581 . . . . 0.0 110.24 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -64.42 -42.74 95.89 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.221 1.009 . . . . 0.0 110.516 172.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.43 -55.3 10.71 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.485 HD13 HG21 ' A' ' 6' ' ' VAL . 42.1 mm -43.93 -31.91 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 166.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -76.1 -53.56 8.14 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.69 -43.18 80.22 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.891 0.877 . . . . 0.0 112.486 174.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -33.04 58.94 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.159 0.584 . . . . 0.0 111.418 -173.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -59.95 -54.96 39.93 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 170.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -53.41 -39.66 64.5 Favored 'General case' 0 C--O 1.216 -0.702 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.27 177.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.46 -35.77 46.26 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 122.764 0.426 . . . . 0.0 110.444 -170.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.5 m -64.46 -48.75 74.08 Favored 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.46 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 21.1 mm -57.34 -56.35 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 O-C-N 124.19 0.931 . . . . 0.0 110.444 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.67 -38.72 60.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.04 1.336 . . . . 0.0 111.549 -179.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.415 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.1 tp60 -79.24 -36.16 40.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.845 -178.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.1 m -65.68 -30.54 71.25 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.79 0.836 . . . . 0.0 110.396 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.608 HD22 HG13 ' A' ' 93' ' ' ILE . 27.9 mt -63.37 -23.68 67.52 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.384 0.674 . . . . 0.0 111.156 177.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -114.5 -1.87 13.32 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 177.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 42' ' ' GLN . 42.0 mt -90.86 -52.55 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.18 0.592 . . . . 0.0 110.286 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.442 ' HB2' ' HZ2' ' A' ' 95' ' ' TRP . 27.4 mm-40 -43.47 -45.25 6.32 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.948 1.299 . . . . 0.0 112.187 -176.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.424 ' O ' HD13 ' A' ' 52' ' ' LEU . 7.3 ptp180 -55.25 -54.77 39.28 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 124.308 1.005 . . . . 0.0 111.134 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -70.47 -29.46 66.02 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 122.811 0.444 . . . . 0.0 110.995 -172.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.6 -41.21 97.11 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.161 0.584 . . . . 0.0 111.071 175.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 58.0 mtt180 -71.79 -38.53 70.28 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.984 0.803 . . . . 0.0 111.297 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.513 ' HG ' ' HG3' ' A' ' 77' ' ' ARG . 11.0 mp -71.45 -38.5 71.3 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.058 0.543 . . . . 0.0 111.052 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -77.94 -19.94 53.67 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.531 0.332 . . . . 0.0 111.163 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.03 -48.02 17.09 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.033 0.533 . . . . 0.0 110.202 174.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HE2' ' A' ' 76' ' ' TYR . 73.4 m -79.82 9.66 4.99 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.624 0.769 . . . . 0.0 111.962 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -59.68 -25.91 65.14 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.708 1.203 . . . . 0.0 112.071 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -56.41 -30.33 62.65 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.963 0.905 . . . . 0.0 112.204 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.609 HG23 HE21 ' A' ' 59' ' ' GLN . 5.9 t -110.28 -4.34 15.74 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 111.395 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.609 HE21 HG23 ' A' ' 58' ' ' THR . 25.4 mm-40 -82.78 -19.27 38.1 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.463 0.305 . . . . 0.0 110.181 173.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 13.5 m -69.01 151.79 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 167.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -86.56 -9.32 56.37 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.087 0.555 . . . . 0.0 111.628 -179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -74.35 -23.83 59.08 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.678 0.791 . . . . 0.0 111.455 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.76 140.64 18.31 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 41.6 t -98.62 86.72 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 93.4 mt -132.35 167.88 19.11 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 124.121 0.968 . . . . 0.0 108.894 177.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 76.2 p -73.89 162.66 28.86 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 173.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.52 -45.3 77.13 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.24 0.337 . . . . 0.0 110.512 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -56.32 -49.29 74.74 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.04 176.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 65' ' ' LEU . 17.3 mm-40 -61.41 -47.55 85.26 Favored 'General case' 0 N--CA 1.493 1.679 0 CA-C-O 120.836 0.35 . . . . 0.0 111.004 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 79.7 mttt -62.03 -25.47 67.69 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.458 1.103 . . . . 0.0 112.012 177.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.2 -53.55 5.43 Favored 'General case' 0 C--O 1.212 -0.88 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 6.1 m -54.35 -34.43 61.09 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.919 1.288 . . . . 0.0 112.386 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.41 ' HB3' HE22 ' A' ' 59' ' ' GLN . 50.5 m95 -73.95 -39.1 63.98 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.396 0.678 . . . . 0.0 111.439 173.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.31 62.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.101 0.56 . . . . 0.0 111.1 175.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -81.99 -38.13 25.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.464 1.106 . . . . 0.0 108.651 178.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.474 ' HE2' ' SG ' ' A' ' 55' ' ' CYS . 42.9 t80 -55.67 -48.18 75.48 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.63 171.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.513 ' HG3' ' HG ' ' A' ' 52' ' ' LEU . 75.8 ttt180 -61.24 -54.7 40.81 Favored 'General case' 0 C--N 1.346 0.43 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.984 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -61.05 -47.73 85.03 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 114.394 -1.275 . . . . 0.0 111.989 -170.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.09 89.92 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 123.98 0.8 . . . . 0.0 111.409 -177.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 3.6 tt -66.3 -45.88 78.87 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.335 1.054 . . . . 0.0 109.922 -173.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.451 ' HB3' HD21 ' A' ' 52' ' ' LEU . 17.8 ptm180 -77.57 -27.01 51.3 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.704 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.49 -21.99 66.18 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.476 0.711 . . . . 0.0 110.928 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -63.06 113.43 9.31 Favored Pre-proline 0 CA--C 1.56 1.341 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 174.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -78.78 -170.46 1.0 Allowed 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.216 2.611 . . . . 0.0 112.332 -176.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -86.34 59.25 5.52 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 121.352 0.596 . . . . 0.0 109.773 177.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 27.6 m -67.69 -45.96 73.66 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.536 -177.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.451 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 26.9 m -93.74 81.61 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-O 122.254 1.026 . . . . 0.0 110.676 -176.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.6 t -80.7 -26.16 37.69 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.731 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -87.34 155.14 20.18 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.41 1.084 . . . . 0.0 108.734 171.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 68.1 tp -54.1 100.64 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.464 1.106 . . . . 0.0 111.853 -174.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.451 ' HB2' ' HB ' ' A' ' 87' ' ' VAL . 74.6 m -150.0 144.19 25.66 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.892 0.877 . . . . 0.0 110.342 177.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -73.39 122.56 22.27 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.109 175.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.608 HG13 HD22 ' A' ' 44' ' ' LEU . 1.2 pp -69.29 133.15 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.473 0.709 . . . . 0.0 110.729 174.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.3 p -120.77 117.29 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 171.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.442 ' HZ2' ' HB2' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -138.5 162.52 52.82 Favored Pre-proline 0 N--CA 1.476 0.859 0 C-N-CA 124.73 1.212 . . . . 0.0 108.992 178.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.27 139.77 63.12 Favored 'Trans proline' 0 C--N 1.385 2.495 0 C-N-CA 123.079 2.52 . . . . 0.0 114.199 -173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -93.85 149.93 20.81 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 166.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.8 pp -54.84 140.67 59.63 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -167.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.31 -41.41 9.21 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 122.981 2.454 . . . . 0.0 113.831 -170.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 0.977 0 C-N-CA 123.7 0.8 . . . . 0.0 109.519 -171.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ppp? . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 121.445 0.64 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 pp -113.31 152.2 30.2 Favored 'General case' 0 C--O 1.244 0.775 0 CA-C-N 114.618 -1.174 . . . . 0.0 108.5 170.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.521 HD21 ' HA ' ' A' ' 32' ' ' ILE . 7.6 mp -65.18 101.72 0.57 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.229 0.611 . . . . 0.0 110.692 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -40.03 -35.41 0.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.309 1.443 . . . . 0.0 113.626 170.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.9 t -162.17 131.28 4.35 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.338 0.655 . . . . 0.0 109.652 173.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.36 113.54 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 124.606 1.162 . . . . 0.0 108.372 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 12' ' ' GLU . 42.3 tt0 -82.42 94.79 7.49 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 27' ' ' ALA . 70.3 p -75.85 161.85 74.22 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 114.667 -1.151 . . . . 0.0 110.078 178.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -55.65 -23.12 39.01 Favored 'Trans proline' 0 C--N 1.373 1.824 0 C-N-CA 122.746 2.297 . . . . 0.0 114.528 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -90.01 -2.23 58.1 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.189 0.596 . . . . 0.0 112.175 178.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.5 -176.78 20.59 Favored Glycine 0 C--N 1.349 1.251 0 C-N-CA 123.214 0.435 . . . . 0.0 112.915 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' GLU . 44.6 tt0 -86.82 134.19 33.57 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.2 mm -123.82 138.96 51.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.9 mt -118.9 135.29 54.65 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.386 0.674 . . . . 0.0 110.585 -175.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.2 74.77 0.4 Allowed 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.99 1.316 . . . . 0.0 111.957 170.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.1 p -149.97 141.01 16.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.218 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.8 p -64.89 149.27 49.87 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.442 ' HB3' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -61.77 -24.5 66.87 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.332 0.653 . . . . 0.0 111.377 172.827 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -62.11 -58.56 7.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.297 0.639 . . . . 0.0 110.062 172.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -68.04 -40.98 82.73 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.997 0.519 . . . . 0.0 111.214 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.1 -52.3 20.98 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.891 0.876 . . . . 0.0 111.965 173.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' NH1' ' HG2' ' A' ' 29' ' ' GLU . 18.1 mtp180 -75.27 -33.07 61.22 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -77.38 -60.65 2.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.314 0.646 . . . . 0.0 110.528 -171.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 60.0 t -79.14 -59.39 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.128 0.971 . . . . 0.0 110.656 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -79.77 -22.0 43.73 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.821 -0.627 . . . . 0.0 112.085 -169.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.63 36.97 76.9 Favored Glycine 0 C--N 1.348 1.223 0 O-C-N 123.313 0.383 . . . . 0.0 112.751 -178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.442 ' HB2' HG22 ' A' ' 8' ' ' THR . . . -64.07 127.2 30.4 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.209 1.004 . . . . 0.0 111.079 -179.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.429 ' O ' HG12 ' A' ' 32' ' ' ILE . 72.0 p -58.63 147.87 31.04 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 124.077 0.861 . . . . 0.0 111.169 -178.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.43 ' HG2' ' NH1' ' A' ' 22' ' ' ARG . 34.7 mt-10 -64.81 -25.95 68.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.431 0.692 . . . . 0.0 110.274 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.1 -45.92 91.37 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.302 1.041 . . . . 0.0 110.952 171.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.39 -51.97 31.47 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.775 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.521 ' HA ' HD21 ' A' ' 3' ' ' LEU . 43.8 mm -44.47 -38.43 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 168.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -73.89 -55.75 5.8 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -54.88 -50.13 69.48 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.841 -1.072 . . . . 0.0 112.587 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.49 -37.47 60.16 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.042 0.937 . . . . 0.0 112.313 -170.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -63.83 -46.59 84.38 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -57.96 -38.3 75.75 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.057 0.943 . . . . 0.0 111.779 174.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -80.79 -32.39 35.39 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.203 0.601 . . . . 0.0 110.435 -172.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.0 m -67.54 -54.94 15.71 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 7.6 mm -54.09 -45.01 65.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 C-N-CA 124.284 1.034 . . . . 0.0 111.634 177.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.5 tp -48.65 -51.03 30.39 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.99 1.316 . . . . 0.0 110.953 175.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -80.69 -25.44 38.18 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.234 -177.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 47' ' ' GLU . 52.1 m -65.27 -29.66 70.46 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.165 0.986 . . . . 0.0 110.377 -177.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.452 HD11 ' HB3' ' A' ' 91' ' ' SER . 18.5 mt -63.76 -37.93 89.2 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-O 121.499 0.666 . . . . 0.0 110.099 175.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.811 HH22 ' HA ' ' A' ' 86' ' ' THR . 21.6 ttm-85 -78.06 -36.14 48.74 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.784 -177.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 91.8 mt -64.67 -44.46 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.973 173.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -55.71 -55.89 26.86 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.5 1.52 . . . . 0.0 109.733 -177.07 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.459 ' O ' HD13 ' A' ' 52' ' ' LEU . 17.9 ttp85 -52.44 -55.92 18.58 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.997 176.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -59.37 -38.95 81.76 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.453 0.701 . . . . 0.0 112.144 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -68.76 -38.79 80.33 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.328 0.651 . . . . 0.0 111.755 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 34.7 mtp85 -74.19 -38.56 63.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.289 0.636 . . . . 0.0 111.551 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 77' ' ' ARG . 10.7 mp -69.97 -40.16 75.56 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.403 0.681 . . . . 0.0 110.803 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 15.8 ptp180 -76.09 -21.15 57.03 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.092 0.157 . . . . 0.0 110.641 177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -67.64 -25.63 65.83 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.955 0.502 . . . . 0.0 110.527 173.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HG ' ' HD2' ' A' ' 76' ' ' TYR . 61.9 m -94.4 17.89 12.17 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.416 1.086 . . . . 0.0 111.916 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -61.37 -40.2 93.43 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.8 p-90 -55.09 -33.95 63.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.227 1.011 . . . . 0.0 112.688 -175.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.541 ' HA ' HG11 ' A' ' 63' ' ' VAL . 3.0 t -95.76 -27.13 15.4 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.99 0.916 . . . . 0.0 111.343 -176.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -86.71 -5.18 59.2 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -176.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.56 160.87 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 CA-C-O 121.078 0.466 . . . . 0.0 111.051 172.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -80.55 -16.67 53.64 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.861 174.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.4 -36.99 74.4 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.59 1.156 . . . . 0.0 111.546 179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 58' ' ' THR . 8.8 p -84.74 149.63 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.315 0.646 . . . . 0.0 110.996 -179.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 2.9 p -113.33 102.32 13.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 122.077 0.941 . . . . 0.0 109.543 172.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 70' ' ' LYS . 78.6 mt -126.87 168.84 13.93 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.65 1.18 . . . . 0.0 108.375 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 82.1 p -72.97 157.9 36.52 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 174.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.27 -41.67 72.54 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 123.613 0.571 . . . . 0.0 110.442 173.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.81 -47.16 83.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.211 1.004 . . . . 0.0 112.371 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -63.11 -54.43 38.04 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 122.921 0.489 . . . . 0.0 110.467 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.422 ' HG3' ' HB2' ' A' ' 65' ' ' LEU . 39.4 mttm -57.37 -25.51 59.57 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.6 1.16 . . . . 0.0 112.634 177.152 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.04 15.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -176.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 22.1 m -57.88 -41.13 81.88 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.021 174.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -73.46 -33.97 65.15 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.951 175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.26 -24.29 63.04 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.213 0.605 . . . . 0.0 110.796 173.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -80.0 -38.6 31.76 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.471 ' HD2' ' HG ' ' A' ' 55' ' ' CYS . 41.5 t80 -54.78 -55.58 28.6 Favored 'General case' 0 C--N 1.348 0.539 0 C-N-CA 123.666 0.787 . . . . 0.0 110.032 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.562 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 12.3 ptm85 -69.86 -44.57 69.57 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 114.764 -1.107 . . . . 0.0 112.561 -175.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -67.9 -46.79 70.63 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.424 0.69 . . . . 0.0 112.054 -176.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.51 91.48 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.192 0.597 . . . . 0.0 110.858 178.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 76' ' ' TYR . 5.9 tt -55.26 -41.69 72.52 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.573 1.149 . . . . 0.0 110.96 173.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 54.4 mtp180 -74.36 -27.72 60.8 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.288 0.635 . . . . 0.0 111.712 178.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -62.61 -30.56 71.44 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.74 0.816 . . . . 0.0 110.182 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.516 HD12 ' HD2' ' A' ' 84' ' ' PRO . 64.8 tp -74.07 117.44 61.46 Favored Pre-proline 0 CA--C 1.55 0.947 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 170.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.516 ' HD2' HD12 ' A' ' 83' ' ' LEU . 60.6 Cg_endo -69.65 97.46 0.63 Allowed 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.529 2.153 . . . . 0.0 112.51 177.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.36 -7.34 53.49 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.967 168.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.811 ' HA ' HH22 ' A' ' 45' ' ' ARG . 9.2 t -79.35 -2.1 40.04 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.65 1.18 . . . . 0.0 111.945 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.9 m -108.5 149.38 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.29 0.636 . . . . 0.0 110.925 178.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 60.9 m -90.04 -19.55 24.26 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 124.158 0.983 . . . . 0.0 109.868 170.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -53.5 -65.02 0.64 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.322 1.049 . . . . 0.0 111.533 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 75.5 mt -122.02 93.06 3.87 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 169.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HB3' HD11 ' A' ' 44' ' ' LEU . 43.1 m -88.95 23.32 2.41 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 124.624 1.17 . . . . 0.0 111.133 179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.417 ' HG2' ' H ' ' A' ' 92' ' ' GLN . 2.6 pt20 -84.19 95.16 8.56 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.306 1.042 . . . . 0.0 110.257 178.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.495 ' HA ' HD21 ' A' ' 83' ' ' LEU . 44.7 pt -81.98 96.32 3.39 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 121.851 0.834 . . . . 0.0 111.284 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 3.6 p -124.04 88.06 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TRP . . . . . 0.541 ' HB2' ' HD2' ' A' ' 96' ' ' PRO . 0.4 OUTLIER -117.44 165.85 14.72 Favored Pre-proline 0 N--CA 1.478 0.927 0 CA-C-N 114.108 -1.405 . . . . 0.0 109.991 -176.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 95' ' ' TRP . 18.8 Cg_endo -55.17 143.38 75.0 Favored 'Trans proline' 0 C--N 1.394 2.936 0 C-N-CA 122.449 2.099 . . . . 0.0 113.139 -175.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -88.76 150.11 23.11 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 165.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 2.4 pp -59.74 135.57 89.69 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 122.856 0.462 . . . . 0.0 111.581 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -57.69 -37.56 96.3 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.723 2.949 . . . . 0.0 114.804 -168.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 CA--C 1.556 1.173 0 CA-C-O 118.799 -0.62 . . . . 0.0 109.662 -173.799 . . . . . . . . 0 0 . 1 stop_ save_