data_2rlk_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 2rlk _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.327 0.108 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.5 mttt . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p . . . . . 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.409 ' CD2' ' CB ' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.7 mttt . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.47 0.569 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.551 0.993 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p . . . . . 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 119.299 -0.382 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.4 tttt . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.2 p90 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.58 -13.32 16.49 Favored 'Trans proline' 0 N--CA 1.442 -1.551 0 C-N-CA 123.063 2.508 . . . . 0.0 110.477 -169.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.63 17.03 10.13 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 127.93 2.492 . . . . 0.0 113.6 174.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -121.08 139.8 29.93 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 128.169 2.588 . . . . 0.0 109.62 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -134.38 72.66 1.47 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -127.75 60.0 1.45 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.034 1.333 . . . . 0.0 111.452 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -54.87 153.86 5.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.314 1.046 . . . . 0.0 111.152 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -73.45 93.84 2.02 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.074 0.95 . . . . 0.0 110.676 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -85.54 -57.4 3.08 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.101 0.961 . . . . 0.0 112.131 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 O-C-N 119.122 -2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.0 p90 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -77.06 -25.36 8.84 Favored 'Trans proline' 0 N--CA 1.439 -1.726 0 C-N-CA 122.541 2.161 . . . . 0.0 109.943 -168.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.46 43.62 0.19 Allowed 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 127.938 2.495 . . . . 0.0 111.667 169.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -165.44 159.52 13.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 125.349 1.46 . . . . 0.0 110.209 -173.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t -130.47 27.74 4.99 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -126.06 78.67 1.78 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.8 1.64 . . . . 0.0 113.392 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -102.45 21.03 15.89 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.023 1.729 . . . . 0.0 112.761 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.76 21.37 7.67 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.08 1.752 . . . . 0.0 112.441 -175.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -136.35 105.92 6.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 122.267 1.032 . . . . 0.0 111.68 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.094 -1.628 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.4 p90 . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.177 -0.439 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.29 -23.65 8.63 Favored 'Trans proline' 0 N--CA 1.442 -1.554 0 C-N-CA 122.024 1.816 . . . . 0.0 110.212 -168.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.09 45.19 14.98 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.714 2.406 . . . . 0.0 113.679 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.1 144.3 0.1 Allowed Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 127.509 2.324 . . . . 0.0 111.183 -170.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t -132.5 24.04 4.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -73.55 32.26 0.08 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.871 1.668 . . . . 0.0 114.104 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -105.98 177.01 4.98 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.74 1.216 . . . . 0.0 110.549 -178.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.0 21.0 13.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.725 2.01 . . . . 0.0 112.382 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -113.66 -74.24 0.63 Allowed 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 125.041 1.336 . . . . 0.0 110.101 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 O-C-N 119.378 -2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 6.0 p90 . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 119.691 -0.195 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.9 -20.91 11.4 Favored 'Trans proline' 0 N--CA 1.436 -1.859 0 C-N-CA 122.398 2.065 . . . . 0.0 109.695 -171.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.63 18.47 11.41 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.625 1.57 . . . . 0.0 112.526 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -85.51 156.81 59.04 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 126.301 1.84 . . . . 0.0 111.353 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -124.07 -29.84 3.56 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 58.09 44.02 19.91 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.842 1.257 . . . . 0.0 112.906 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -69.42 174.44 4.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.39 1.476 . . . . 0.0 112.105 176.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -138.87 42.45 2.11 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.729 1.612 . . . . 0.0 113.178 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -110.14 14.29 22.92 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.44 1.096 . . . . 0.0 113.041 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.778 -2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.1 p90 . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 119.338 -0.363 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -76.43 -21.12 13.55 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 122.357 2.038 . . . . 0.0 109.793 -169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.24 19.85 7.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.031 2.132 . . . . 0.0 113.014 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -112.74 81.77 4.58 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 126.402 1.881 . . . . 0.0 108.869 -176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -125.41 1.33 7.69 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.44 28.16 0.66 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.692 1.597 . . . . 0.0 113.802 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -114.8 169.38 9.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.922 1.289 . . . . 0.0 110.278 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? 59.13 25.05 13.46 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.0 112.833 -176.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -83.0 -71.11 0.51 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.312 1.045 . . . . 0.0 110.822 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.471 0 O-C-N 119.154 -2.216 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -80.49 -22.74 6.53 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.399 2.066 . . . . 0.0 110.381 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.21 19.71 3.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.919 2.488 . . . . 0.0 114.62 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -103.03 157.83 32.96 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 126.818 2.047 . . . . 0.0 111.647 -177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p -127.76 85.41 2.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.5 mtm180 -128.1 63.45 1.41 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.242 1.017 . . . . 0.0 110.981 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.76 172.88 0.84 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.166 0.987 . . . . 0.0 112.315 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.7 91.19 3.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.476 1.11 . . . . 0.0 109.798 -174.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.62 -51.17 2.76 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.199 1.0 . . . . 0.0 110.747 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 O-C-N 119.509 -1.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.161 -0.447 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -76.56 -28.09 7.01 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 121.888 1.725 . . . . 0.0 109.789 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.72 18.31 10.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 127.986 2.514 . . . . 0.0 114.455 176.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm 76.5 156.59 0.15 Allowed Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.548 2.739 . . . . 0.0 110.449 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p -127.69 8.3 6.34 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -74.85 29.35 0.09 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.884 2.074 . . . . 0.0 114.504 176.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -84.11 179.42 7.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.895 0.878 . . . . 0.0 111.515 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.3 mmm-85 -108.2 -21.93 12.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 117.319 -1.324 . . . . 0.0 114.126 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 p90 44.16 2.26 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 128.606 2.763 . . . . 0.0 117.271 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 118.38 -2.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.5 p90 . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -76.25 -25.7 9.72 Favored 'Trans proline' 0 N--CA 1.444 -1.437 0 C-N-CA 122.652 2.235 . . . . 0.0 110.095 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.34 38.76 5.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.089 2.156 . . . . 0.0 112.601 169.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.33 143.81 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 128.5 2.72 . . . . 0.0 111.857 -168.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.409 ' CB ' ' CD2' ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.409 ' CD2' ' CB ' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -130.52 76.88 1.75 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -118.86 62.08 0.79 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.639 1.576 . . . . 0.0 110.364 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -56.53 154.66 8.3 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.818 0.818 . . . . 0.0 111.511 171.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.82 22.03 11.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.77 1.628 . . . . 0.0 111.87 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.02 142.92 58.19 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.241 1.02 . . . . 0.0 111.547 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 119.74 -1.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.58 -26.42 7.13 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 121.86 1.707 . . . . 0.0 109.883 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.33 25.67 7.8 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.553 2.341 . . . . 0.0 113.463 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? -140.62 159.6 62.26 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.489 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m -132.24 84.39 2.15 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -125.89 80.63 1.92 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 126.035 1.734 . . . . 0.0 109.893 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.88 156.64 26.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.738 0.78 . . . . 0.0 111.163 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 26.4 ptt-85 -133.03 50.85 2.2 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.073 1.349 . . . . 0.0 111.598 -176.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -61.59 12.08 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 117.742 -3.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.6 p90 . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -80.28 -9.54 13.84 Favored 'Trans proline' 0 N--CA 1.438 -1.793 0 C-N-CA 123.127 2.551 . . . . 0.0 110.34 -173.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.85 19.71 11.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.86 2.464 . . . . 0.0 114.195 173.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? -120.76 138.11 27.23 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 128.063 2.545 . . . . 0.0 109.475 -174.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -123.77 4.95 8.8 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 52.69 29.74 7.81 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.193 1.797 . . . . 0.0 113.694 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 60.71 20.3 10.33 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.648 1.579 . . . . 0.0 114.58 -172.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -92.8 79.78 4.71 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.155 1.382 . . . . 0.0 111.008 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 57.8 22.68 8.8 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.285 1.034 . . . . 0.0 113.566 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 119.151 -2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 16.0 p90 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.306 -0.378 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.76 -32.94 5.34 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 C-N-CA 121.976 1.784 . . . . 0.0 108.835 -168.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.41 20.92 12.53 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.606 2.362 . . . . 0.0 113.156 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.2 143.62 49.92 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.993 2.517 . . . . 0.0 108.43 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -132.6 67.01 1.54 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.2 ptt85 -129.95 9.78 5.39 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -71.55 101.48 2.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.923 1.289 . . . . 0.0 110.201 -178.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 58.62 23.9 11.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.796 1.238 . . . . 0.0 112.659 178.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -71.44 157.81 37.38 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.323 1.049 . . . . 0.0 112.061 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 119.757 -1.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.9 p90 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 119.138 -0.458 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -76.94 -18.28 14.82 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 122.781 2.321 . . . . 0.0 110.097 -170.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.48 28.09 2.93 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 127.504 2.321 . . . . 0.0 112.619 169.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.7 mttt 75.34 157.77 0.16 Allowed Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 129.37 3.068 . . . . 0.0 110.132 -175.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p -123.18 -44.68 2.15 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 50.26 27.62 2.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.863 1.665 . . . . 0.0 112.962 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -67.04 168.23 10.43 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.419 1.104 . . . . 0.0 112.173 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.0 ptt180 -110.89 20.28 17.69 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.301 1.84 . . . . 0.0 113.155 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -115.8 24.24 11.66 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.415 1.486 . . . . 0.0 112.406 -178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.54 0 O-C-N 118.581 -2.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 CA--C 1.497 -1.08 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.25 -15.36 20.26 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 O-C-N 124.486 1.782 . . . . 0.0 110.605 -176.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.8 167.42 2.15 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 124.668 1.187 . . . . 0.0 111.725 -176.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -58.22 151.33 47.99 Favored Pre-proline 0 N--CA 1.47 0.569 0 O-C-N 121.379 -0.826 . . . . 0.0 113.041 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t -130.63 14.04 5.42 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -97.96 69.29 2.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.111 1.364 . . . . 0.0 111.277 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.25 178.86 8.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.011 172.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mmm-85 -132.32 108.04 8.94 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.864 1.266 . . . . 0.0 109.277 179.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -60.46 80.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.164 1.459 . . . . 0.0 112.371 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.712 0 O-C-N 119.646 -1.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.68 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -10.13 13.9 Favored 'Trans proline' 0 N--CA 1.44 -1.667 0 C-N-CA 123.165 2.577 . . . . 0.0 110.69 -174.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.6 20.22 8.79 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 127.987 2.515 . . . . 0.0 113.797 174.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -128.71 139.38 35.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.844 2.458 . . . . 0.0 109.198 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 t -122.27 12.65 10.25 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.73 82.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.703 1.601 . . . . 0.0 111.479 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 60.21 38.34 20.12 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.702 1.601 . . . . 0.0 112.311 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -104.94 9.68 34.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.423 1.089 . . . . 0.0 113.647 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -157.48 163.91 37.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.092 0.957 . . . . 0.0 111.071 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.093 -1.63 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 19.7 p90 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 119.223 -0.417 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.96 -21.02 14.5 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 122.367 2.045 . . . . 0.0 109.927 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.02 25.27 14.95 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 127.953 2.501 . . . . 0.0 113.365 172.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 62.88 164.8 0.11 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 129.637 3.175 . . . . 0.0 113.038 -170.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p -130.49 78.82 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -124.73 88.6 2.92 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.905 -1.122 . . . . 0.0 111.977 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.12 27.81 7.44 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.017 1.327 . . . . 0.0 112.987 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -111.35 63.03 0.61 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.413 1.485 . . . . 0.0 111.074 -174.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -142.83 104.5 4.35 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 122.07 0.938 . . . . 0.0 111.252 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.58 0 O-C-N 120.321 -1.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.6 p90 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 119.199 -0.429 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.92 -10.81 21.52 Favored 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 121.852 1.701 . . . . 0.0 110.751 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.99 83.13 0.95 Allowed 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.304 1.042 . . . . 0.0 110.163 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -59.78 154.42 47.37 Favored Pre-proline 0 CA--C 1.548 0.879 0 O-C-N 121.194 -0.941 . . . . 0.0 111.525 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.88 -3.59 55.83 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -81.09 52.63 1.82 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.771 1.629 . . . . 0.0 112.247 -173.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 tp60 -119.52 163.46 17.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.801 1.24 . . . . 0.0 111.657 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.13 57.79 1.5 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.674 1.589 . . . . 0.0 111.503 -178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -83.59 -32.41 25.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.414 176.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 119.404 -2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.6 p90 . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.05 -15.14 13.15 Favored 'Trans proline' 0 N--CA 1.439 -1.704 0 C-N-CA 122.286 1.991 . . . . 0.0 110.163 -171.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.09 18.83 8.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.362 2.265 . . . . 0.0 113.908 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -137.06 140.86 32.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 127.833 2.453 . . . . 0.0 108.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t -165.62 114.89 1.01 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -132.14 64.74 1.59 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.006 1.322 . . . . 0.0 110.652 177.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -64.14 161.33 16.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 122.18 0.991 . . . . 0.0 112.285 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -83.16 79.28 9.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.537 1.135 . . . . 0.0 111.985 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -80.52 103.62 10.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.693 1.235 . . . . 0.0 112.052 177.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.613 0 O-C-N 119.867 -1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 119.048 -0.501 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -76.87 -17.05 15.87 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 C-N-CA 123.251 2.634 . . . . 0.0 110.35 -170.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.43 24.55 11.97 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 127.585 2.354 . . . . 0.0 112.601 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.4 tttt -158.65 144.71 12.42 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.26 1.824 . . . . 0.0 108.633 -175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -85.53 -20.74 29.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.55 71.62 1.36 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.719 1.607 . . . . 0.0 110.728 -174.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -74.59 160.86 30.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.799 0.809 . . . . 0.0 112.317 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -64.09 -25.05 67.93 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -61.55 -25.38 67.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.669 0.788 . . . . 0.0 112.149 171.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 O-C-N 118.699 -2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -76.11 -17.68 16.99 Favored 'Trans proline' 0 N--CA 1.438 -1.789 0 C-N-CA 122.383 2.055 . . . . 0.0 110.155 -171.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.86 24.5 14.58 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 127.505 2.322 . . . . 0.0 113.4 173.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt 64.02 162.59 0.12 Allowed Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 127.811 2.445 . . . . 0.0 113.335 -168.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.3 t -128.53 21.87 6.01 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -121.32 56.49 1.04 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.23 1.812 . . . . 0.0 112.667 -178.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -125.55 176.17 7.03 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.61 1.564 . . . . 0.0 110.349 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -132.13 99.57 4.76 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.991 1.316 . . . . 0.0 107.884 -176.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -110.54 174.07 6.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.556 1.17 . . . . 0.0 111.09 178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.674 0 O-C-N 119.063 -2.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.3 p90 . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -78.54 -21.34 10.16 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 C-N-CA 122.061 1.841 . . . . 0.0 109.28 -170.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.77 19.53 7.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.264 1.426 . . . . 0.0 112.899 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -83.99 136.92 40.76 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 125.608 1.563 . . . . 0.0 109.546 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p -129.23 90.17 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -131.91 44.73 2.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.296 1.438 . . . . 0.0 112.586 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -116.81 174.91 5.83 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.937 1.295 . . . . 0.0 111.503 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -112.58 22.1 14.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.321 2.248 . . . . 0.0 112.607 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -73.07 155.96 39.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.516 1.15 . . . . 0.0 112.31 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.671 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 30' ' ' LEU . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 31' ' ' VAL . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 30' ' ' LEU . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 28' ' ' LEU . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.327 0.108 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.584 ' HG3' HD13 ' A' ' 17' ' ' LEU . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HG3' HD13 ' A' ' 17' ' ' LEU . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.551 ' HA ' HG12 ' A' ' 31' ' ' VAL . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.551 HG12 ' HA ' ' A' ' 28' ' ' LEU . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.469 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.607 ' HA ' HG22 ' A' ' 32' ' ' THR . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.607 HG22 ' HA ' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HD3' HD12 ' A' ' 24' ' ' LEU . 16.5 mttt . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.408 HD12 ' HD3' ' A' ' 4' ' ' LYS . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p . . . . . 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 17' ' ' LEU . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.703 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.545 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.594 ' HA ' HG22 ' A' ' 32' ' ' THR . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 29' ' ' ASN . 1.4 t . . . . . 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HG2' ' CD1' ' A' ' 27' ' ' TYR . 23.7 mttt . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.401 ' HD3' ' CG ' ' A' ' 20' ' ' TYR . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' CG ' ' HD3' ' A' ' 8' ' ' PRO . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 31' ' ' VAL . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' CE1' ' A' ' 27' ' ' TYR . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.47 0.569 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.575 ' HG3' HD13 ' A' ' 17' ' ' LEU . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.575 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' HA ' HG12 ' A' ' 31' ' ' VAL . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.568 HD12 ' CE2' ' A' ' 21' ' ' TYR . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' HD12 ' A' ' 17' ' ' LEU . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.56 ' CE2' HG21 ' A' ' 31' ' ' VAL . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG21 ' CE2' ' A' ' 27' ' ' TYR . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 3.0 t . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.8 OUTLIER . . . . . 0 CA--C 1.551 0.993 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.697 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p . . . . . 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 119.299 -0.382 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HG3' HD13 ' A' ' 17' ' ' LEU . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.436 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HE3' HD13 ' A' ' 24' ' ' LEU . 17.4 tttt . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.601 HD13 ' HE3' ' A' ' 4' ' ' LYS . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 28' ' ' LEU . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.3 t . . . . . 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HG3' HD13 ' A' ' 17' ' ' LEU . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.521 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.2 p90 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.58 -13.32 16.49 Favored 'Trans proline' 0 N--CA 1.442 -1.551 0 C-N-CA 123.063 2.508 . . . . 0.0 110.477 -169.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.63 17.03 10.13 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 127.93 2.492 . . . . 0.0 113.6 174.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -121.08 139.8 29.93 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 128.169 2.588 . . . . 0.0 109.62 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.671 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 30' ' ' LEU . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -134.38 72.66 1.47 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -127.75 60.0 1.45 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.034 1.333 . . . . 0.0 111.452 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -54.87 153.86 5.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.314 1.046 . . . . 0.0 111.152 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -73.45 93.84 2.02 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.074 0.95 . . . . 0.0 110.676 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -85.54 -57.4 3.08 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.101 0.961 . . . . 0.0 112.131 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 O-C-N 119.122 -2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.0 p90 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -77.06 -25.36 8.84 Favored 'Trans proline' 0 N--CA 1.439 -1.726 0 C-N-CA 122.541 2.161 . . . . 0.0 109.943 -168.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.46 43.62 0.19 Allowed 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 127.938 2.495 . . . . 0.0 111.667 169.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -165.44 159.52 13.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 125.349 1.46 . . . . 0.0 110.209 -173.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 31' ' ' VAL . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 30' ' ' LEU . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 28' ' ' LEU . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t -130.47 27.74 4.99 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -126.06 78.67 1.78 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.8 1.64 . . . . 0.0 113.392 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -102.45 21.03 15.89 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.023 1.729 . . . . 0.0 112.761 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.76 21.37 7.67 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.08 1.752 . . . . 0.0 112.441 -175.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -136.35 105.92 6.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 122.267 1.032 . . . . 0.0 111.68 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.094 -1.628 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.4 p90 . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.177 -0.439 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.29 -23.65 8.63 Favored 'Trans proline' 0 N--CA 1.442 -1.554 0 C-N-CA 122.024 1.816 . . . . 0.0 110.212 -168.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.09 45.19 14.98 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.714 2.406 . . . . 0.0 113.679 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.1 144.3 0.1 Allowed Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 127.509 2.324 . . . . 0.0 111.183 -170.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.584 ' HG3' HD13 ' A' ' 17' ' ' LEU . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t -132.5 24.04 4.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -73.55 32.26 0.08 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.871 1.668 . . . . 0.0 114.104 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -105.98 177.01 4.98 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.74 1.216 . . . . 0.0 110.549 -178.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.0 21.0 13.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.725 2.01 . . . . 0.0 112.382 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -113.66 -74.24 0.63 Allowed 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 125.041 1.336 . . . . 0.0 110.101 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 O-C-N 119.378 -2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 6.0 p90 . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 119.691 -0.195 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.9 -20.91 11.4 Favored 'Trans proline' 0 N--CA 1.436 -1.859 0 C-N-CA 122.398 2.065 . . . . 0.0 109.695 -171.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.63 18.47 11.41 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.625 1.57 . . . . 0.0 112.526 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -85.51 156.81 59.04 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 126.301 1.84 . . . . 0.0 111.353 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HG3' HD13 ' A' ' 17' ' ' LEU . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.551 ' HA ' HG12 ' A' ' 31' ' ' VAL . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.551 HG12 ' HA ' ' A' ' 28' ' ' LEU . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -124.07 -29.84 3.56 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 58.09 44.02 19.91 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.842 1.257 . . . . 0.0 112.906 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -69.42 174.44 4.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.39 1.476 . . . . 0.0 112.105 176.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -138.87 42.45 2.11 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.729 1.612 . . . . 0.0 113.178 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -110.14 14.29 22.92 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.44 1.096 . . . . 0.0 113.041 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.778 -2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.1 p90 . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 119.338 -0.363 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -76.43 -21.12 13.55 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 122.357 2.038 . . . . 0.0 109.793 -169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.24 19.85 7.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.031 2.132 . . . . 0.0 113.014 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -112.74 81.77 4.58 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 126.402 1.881 . . . . 0.0 108.869 -176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.469 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.607 ' HA ' HG22 ' A' ' 32' ' ' THR . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.607 HG22 ' HA ' ' A' ' 29' ' ' ASN . 0.9 OUTLIER -125.41 1.33 7.69 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.44 28.16 0.66 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.692 1.597 . . . . 0.0 113.802 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -114.8 169.38 9.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.922 1.289 . . . . 0.0 110.278 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? 59.13 25.05 13.46 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.0 112.833 -176.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -83.0 -71.11 0.51 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.312 1.045 . . . . 0.0 110.822 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.471 0 O-C-N 119.154 -2.216 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -80.49 -22.74 6.53 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.399 2.066 . . . . 0.0 110.381 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.21 19.71 3.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.919 2.488 . . . . 0.0 114.62 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HD3' HD12 ' A' ' 24' ' ' LEU . 16.5 mttt -103.03 157.83 32.96 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 126.818 2.047 . . . . 0.0 111.647 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.408 HD12 ' HD3' ' A' ' 4' ' ' LYS . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p -127.76 85.41 2.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.5 mtm180 -128.1 63.45 1.41 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.242 1.017 . . . . 0.0 110.981 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.76 172.88 0.84 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.166 0.987 . . . . 0.0 112.315 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.7 91.19 3.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.476 1.11 . . . . 0.0 109.798 -174.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.62 -51.17 2.76 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.199 1.0 . . . . 0.0 110.747 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 O-C-N 119.509 -1.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.161 -0.447 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -76.56 -28.09 7.01 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 121.888 1.725 . . . . 0.0 109.789 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.72 18.31 10.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 127.986 2.514 . . . . 0.0 114.455 176.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm 76.5 156.59 0.15 Allowed Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.548 2.739 . . . . 0.0 110.449 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 17' ' ' LEU . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p -127.69 8.3 6.34 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -74.85 29.35 0.09 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.884 2.074 . . . . 0.0 114.504 176.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -84.11 179.42 7.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.895 0.878 . . . . 0.0 111.515 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.3 mmm-85 -108.2 -21.93 12.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 117.319 -1.324 . . . . 0.0 114.126 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 p90 44.16 2.26 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 128.606 2.763 . . . . 0.0 117.271 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 118.38 -2.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.5 p90 . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -76.25 -25.7 9.72 Favored 'Trans proline' 0 N--CA 1.444 -1.437 0 C-N-CA 122.652 2.235 . . . . 0.0 110.095 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.34 38.76 5.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.089 2.156 . . . . 0.0 112.601 169.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.33 143.81 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 128.5 2.72 . . . . 0.0 111.857 -168.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.703 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -130.52 76.88 1.75 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -118.86 62.08 0.79 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.639 1.576 . . . . 0.0 110.364 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -56.53 154.66 8.3 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.818 0.818 . . . . 0.0 111.511 171.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.82 22.03 11.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.77 1.628 . . . . 0.0 111.87 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.02 142.92 58.19 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.241 1.02 . . . . 0.0 111.547 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 119.74 -1.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.58 -26.42 7.13 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 121.86 1.707 . . . . 0.0 109.883 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.33 25.67 7.8 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.553 2.341 . . . . 0.0 113.463 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? -140.62 159.6 62.26 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.489 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.545 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m -132.24 84.39 2.15 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -125.89 80.63 1.92 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 126.035 1.734 . . . . 0.0 109.893 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.88 156.64 26.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.738 0.78 . . . . 0.0 111.163 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 26.4 ptt-85 -133.03 50.85 2.2 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.073 1.349 . . . . 0.0 111.598 -176.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -61.59 12.08 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 117.742 -3.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.6 p90 . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -80.28 -9.54 13.84 Favored 'Trans proline' 0 N--CA 1.438 -1.793 0 C-N-CA 123.127 2.551 . . . . 0.0 110.34 -173.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.85 19.71 11.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.86 2.464 . . . . 0.0 114.195 173.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? -120.76 138.11 27.23 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 128.063 2.545 . . . . 0.0 109.475 -174.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.594 ' HA ' HG22 ' A' ' 32' ' ' THR . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 29' ' ' ASN . 1.4 t -123.77 4.95 8.8 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 52.69 29.74 7.81 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.193 1.797 . . . . 0.0 113.694 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 60.71 20.3 10.33 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.648 1.579 . . . . 0.0 114.58 -172.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -92.8 79.78 4.71 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.155 1.382 . . . . 0.0 111.008 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 57.8 22.68 8.8 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.285 1.034 . . . . 0.0 113.566 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 119.151 -2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.533 ' HD1' ' HB2' ' A' ' 3' ' ' ALA . 16.0 p90 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.306 -0.378 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.76 -32.94 5.34 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 C-N-CA 121.976 1.784 . . . . 0.0 108.835 -168.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.533 ' HB2' ' HD1' ' A' ' 1' ' ' TYR . . . 63.41 20.92 12.53 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.606 2.362 . . . . 0.0 113.156 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.2 143.62 49.92 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.993 2.517 . . . . 0.0 108.43 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -132.6 67.01 1.54 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.2 ptt85 -129.95 9.78 5.39 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -71.55 101.48 2.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.923 1.289 . . . . 0.0 110.201 -178.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 58.62 23.9 11.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.796 1.238 . . . . 0.0 112.659 178.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -71.44 157.81 37.38 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.323 1.049 . . . . 0.0 112.061 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 119.757 -1.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.9 p90 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 119.138 -0.458 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -76.94 -18.28 14.82 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 122.781 2.321 . . . . 0.0 110.097 -170.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.48 28.09 2.93 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 127.504 2.321 . . . . 0.0 112.619 169.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HG2' ' CD1' ' A' ' 27' ' ' TYR . 23.7 mttt 75.34 157.77 0.16 Allowed Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 129.37 3.068 . . . . 0.0 110.132 -175.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.401 ' HD3' ' CG ' ' A' ' 20' ' ' TYR . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' CG ' ' HD3' ' A' ' 8' ' ' PRO . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 31' ' ' VAL . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' CE1' ' A' ' 27' ' ' TYR . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p -123.18 -44.68 2.15 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 50.26 27.62 2.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.863 1.665 . . . . 0.0 112.962 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -67.04 168.23 10.43 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.419 1.104 . . . . 0.0 112.173 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.0 ptt180 -110.89 20.28 17.69 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.301 1.84 . . . . 0.0 113.155 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -115.8 24.24 11.66 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.415 1.486 . . . . 0.0 112.406 -178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.54 0 O-C-N 118.581 -2.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 3' ' ' ALA . 2.8 p90 . . . . . 0 CA--C 1.497 -1.08 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.25 -15.36 20.26 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 O-C-N 124.486 1.782 . . . . 0.0 110.605 -176.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.414 ' HB3' ' CD1' ' A' ' 1' ' ' TYR . . . -59.8 167.42 2.15 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 124.668 1.187 . . . . 0.0 111.725 -176.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -58.22 151.33 47.99 Favored Pre-proline 0 N--CA 1.47 0.569 0 O-C-N 121.379 -0.826 . . . . 0.0 113.041 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.575 ' HG3' HD13 ' A' ' 17' ' ' LEU . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.575 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' HA ' HG12 ' A' ' 31' ' ' VAL . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t -130.63 14.04 5.42 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -97.96 69.29 2.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.111 1.364 . . . . 0.0 111.277 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.25 178.86 8.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.011 172.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mmm-85 -132.32 108.04 8.94 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.864 1.266 . . . . 0.0 109.277 179.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -60.46 80.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.164 1.459 . . . . 0.0 112.371 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.712 0 O-C-N 119.646 -1.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.68 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -10.13 13.9 Favored 'Trans proline' 0 N--CA 1.44 -1.667 0 C-N-CA 123.165 2.577 . . . . 0.0 110.69 -174.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.6 20.22 8.79 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 127.987 2.515 . . . . 0.0 113.797 174.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -128.71 139.38 35.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.844 2.458 . . . . 0.0 109.198 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD12 ' CE2' ' A' ' 21' ' ' TYR . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' HD12 ' A' ' 17' ' ' LEU . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.56 ' CE2' HG21 ' A' ' 31' ' ' VAL . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG21 ' CE2' ' A' ' 27' ' ' TYR . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 3.0 t -122.27 12.65 10.25 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.73 82.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.703 1.601 . . . . 0.0 111.479 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 60.21 38.34 20.12 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.702 1.601 . . . . 0.0 112.311 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -104.94 9.68 34.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.423 1.089 . . . . 0.0 113.647 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -157.48 163.91 37.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.092 0.957 . . . . 0.0 111.071 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.093 -1.63 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 19.7 p90 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 119.223 -0.417 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.96 -21.02 14.5 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 122.367 2.045 . . . . 0.0 109.927 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.02 25.27 14.95 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 127.953 2.501 . . . . 0.0 113.365 172.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.8 OUTLIER 62.88 164.8 0.11 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 129.637 3.175 . . . . 0.0 113.038 -170.477 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.697 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p -130.49 78.82 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -124.73 88.6 2.92 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.905 -1.122 . . . . 0.0 111.977 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.12 27.81 7.44 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.017 1.327 . . . . 0.0 112.987 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -111.35 63.03 0.61 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.413 1.485 . . . . 0.0 111.074 -174.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -142.83 104.5 4.35 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 122.07 0.938 . . . . 0.0 111.252 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.58 0 O-C-N 120.321 -1.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.6 p90 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 119.199 -0.429 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.92 -10.81 21.52 Favored 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 121.852 1.701 . . . . 0.0 110.751 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.99 83.13 0.95 Allowed 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.304 1.042 . . . . 0.0 110.163 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -59.78 154.42 47.37 Favored Pre-proline 0 CA--C 1.548 0.879 0 O-C-N 121.194 -0.941 . . . . 0.0 111.525 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.88 -3.59 55.83 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -81.09 52.63 1.82 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.771 1.629 . . . . 0.0 112.247 -173.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 tp60 -119.52 163.46 17.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.801 1.24 . . . . 0.0 111.657 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.13 57.79 1.5 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.674 1.589 . . . . 0.0 111.503 -178.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -83.59 -32.41 25.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.414 176.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 119.404 -2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.6 p90 . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.05 -15.14 13.15 Favored 'Trans proline' 0 N--CA 1.439 -1.704 0 C-N-CA 122.286 1.991 . . . . 0.0 110.163 -171.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.09 18.83 8.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.362 2.265 . . . . 0.0 113.908 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -137.06 140.86 32.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 127.833 2.453 . . . . 0.0 108.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HG3' HD13 ' A' ' 17' ' ' LEU . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.436 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t -165.62 114.89 1.01 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -132.14 64.74 1.59 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.006 1.322 . . . . 0.0 110.652 177.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -64.14 161.33 16.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 122.18 0.991 . . . . 0.0 112.285 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -83.16 79.28 9.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.537 1.135 . . . . 0.0 111.985 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -80.52 103.62 10.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.693 1.235 . . . . 0.0 112.052 177.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.613 0 O-C-N 119.867 -1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 119.048 -0.501 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -76.87 -17.05 15.87 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 C-N-CA 123.251 2.634 . . . . 0.0 110.35 -170.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.43 24.55 11.97 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 127.585 2.354 . . . . 0.0 112.601 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HE3' HD13 ' A' ' 24' ' ' LEU . 17.4 tttt -158.65 144.71 12.42 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.26 1.824 . . . . 0.0 108.633 -175.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.601 HD13 ' HE3' ' A' ' 4' ' ' LYS . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -85.53 -20.74 29.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.55 71.62 1.36 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.719 1.607 . . . . 0.0 110.728 -174.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -74.59 160.86 30.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.799 0.809 . . . . 0.0 112.317 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -64.09 -25.05 67.93 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -61.55 -25.38 67.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.669 0.788 . . . . 0.0 112.149 171.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 O-C-N 118.699 -2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -76.11 -17.68 16.99 Favored 'Trans proline' 0 N--CA 1.438 -1.789 0 C-N-CA 122.383 2.055 . . . . 0.0 110.155 -171.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.86 24.5 14.58 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 127.505 2.322 . . . . 0.0 113.4 173.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt 64.02 162.59 0.12 Allowed Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 127.811 2.445 . . . . 0.0 113.335 -168.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.406 HD12 ' HD3' ' A' ' 33' ' ' ARG . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 28' ' ' LEU . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.3 t -128.53 21.87 6.01 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' HD3' HD12 ' A' ' 30' ' ' LEU . 9.3 ptm180 -121.32 56.49 1.04 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.23 1.812 . . . . 0.0 112.667 -178.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -125.55 176.17 7.03 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.61 1.564 . . . . 0.0 110.349 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -132.13 99.57 4.76 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.991 1.316 . . . . 0.0 107.884 -176.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -110.54 174.07 6.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.556 1.17 . . . . 0.0 111.09 178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.674 0 O-C-N 119.063 -2.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.3 p90 . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -78.54 -21.34 10.16 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 C-N-CA 122.061 1.841 . . . . 0.0 109.28 -170.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.77 19.53 7.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.264 1.426 . . . . 0.0 112.899 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -83.99 136.92 40.76 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 125.608 1.563 . . . . 0.0 109.546 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HG3' HD13 ' A' ' 17' ' ' LEU . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.521 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p -129.23 90.17 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -131.91 44.73 2.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.296 1.438 . . . . 0.0 112.586 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -116.81 174.91 5.83 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.937 1.295 . . . . 0.0 111.503 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -112.58 22.1 14.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.321 2.248 . . . . 0.0 112.607 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -73.07 155.96 39.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.516 1.15 . . . . 0.0 112.31 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.671 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 30' ' ' LEU . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.093 -0.48 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 31' ' ' VAL . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 30' ' ' LEU . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 28' ' ' LEU . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 120.327 0.108 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.584 ' HG3' HD13 ' A' ' 17' ' ' LEU . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HG3' HD13 ' A' ' 17' ' ' LEU . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.551 ' HA ' HG12 ' A' ' 31' ' ' VAL . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.551 HG12 ' HA ' ' A' ' 28' ' ' LEU . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.469 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.607 ' HA ' HG22 ' A' ' 32' ' ' THR . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.607 HG22 ' HA ' ' A' ' 29' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HD3' HD12 ' A' ' 24' ' ' LEU . 16.5 mttt . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.408 HD12 ' HD3' ' A' ' 4' ' ' LYS . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p . . . . . 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 17' ' ' LEU . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.703 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 119.494 -0.288 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.545 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? . . . . . 0 CA--C 1.539 0.533 0 CA-C-O 118.492 -0.766 . . . . 0.0 109.475 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.594 ' HA ' HG22 ' A' ' 32' ' ' THR . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 29' ' ' ASN . 1.4 t . . . . . 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HG2' ' CD1' ' A' ' 27' ' ' TYR . 23.7 mttt . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.401 ' HD3' ' CG ' ' A' ' 20' ' ' TYR . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.401 ' CG ' ' HD3' ' A' ' 8' ' ' PRO . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 31' ' ' VAL . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' CE1' ' A' ' 27' ' ' TYR . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p . . . . . 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm . . . . . 0 N--CA 1.47 0.569 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.575 ' HG3' HD13 ' A' ' 17' ' ' LEU . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.575 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.481 ' HA ' HG12 ' A' ' 31' ' ' VAL . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.568 HD12 ' CE2' ' A' ' 21' ' ' TYR . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' HD12 ' A' ' 17' ' ' LEU . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.56 ' CE2' HG21 ' A' ' 31' ' ' VAL . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG21 ' CE2' ' A' ' 27' ' ' TYR . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 3.0 t . . . . . 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.8 OUTLIER . . . . . 0 CA--C 1.551 0.993 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.697 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p . . . . . 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 119.299 -0.382 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HG3' HD13 ' A' ' 17' ' ' LEU . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.436 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HE3' HD13 ' A' ' 24' ' ' LEU . 17.4 tttt . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.601 HD13 ' HE3' ' A' ' 4' ' ' LYS . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 28' ' ' LEU . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.3 t . . . . . 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp . . . . . 0 CA--C 1.535 0.383 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HG3' HD13 ' A' ' 17' ' ' LEU . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.521 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.2 p90 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.58 -13.32 16.49 Favored 'Trans proline' 0 N--CA 1.442 -1.551 0 C-N-CA 123.063 2.508 . . . . 0.0 110.477 -169.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.63 17.03 10.13 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 127.93 2.492 . . . . 0.0 113.6 174.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -121.08 139.8 29.93 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 128.169 2.588 . . . . 0.0 109.62 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.9 124.76 11.78 Favored 'Trans proline' 0 N--CA 1.451 -0.999 0 C-N-CA 125.036 3.824 . . . . 0.0 108.302 177.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -62.45 145.71 53.4 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 119.564 -0.854 . . . . 0.0 110.642 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.39 141.25 53.69 Favored Pre-proline 0 CA--C 1.512 -0.509 0 C-N-CA 124.004 0.922 . . . . 0.0 112.932 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -77.86 176.61 9.8 Favored 'Trans proline' 0 N--CA 1.421 -2.783 0 N-CA-C 108.914 -1.225 . . . . 0.0 108.914 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.56 -132.19 3.94 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 106.982 -2.447 . . . . 0.0 106.982 -177.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 47.75 40.57 12.52 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 118.237 1.019 . . . . 0.0 111.225 -176.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 64.76 35.52 8.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 125.062 1.345 . . . . 0.0 113.136 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.671 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -68.88 141.99 54.91 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 126.459 1.903 . . . . 0.0 111.753 177.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 p -71.28 147.43 93.1 Favored Pre-proline 0 N--CA 1.472 0.647 0 C-N-CA 126.771 2.028 . . . . 0.0 115.679 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.54 -37.78 5.15 Favored 'Trans proline' 0 N--CA 1.443 -1.448 0 C-N-CA 122.709 2.273 . . . . 0.0 111.123 -153.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -63.78 -47.36 81.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.729 1.612 . . . . 0.0 111.531 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -60.45 -44.71 95.55 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.945 0.898 . . . . 0.0 110.918 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -45.51 -51.62 11.47 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.153 2.181 . . . . 0.0 111.127 173.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.3 m -55.82 -58.53 7.48 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.617 1.167 . . . . 0.0 113.254 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 43.4 mtm-85 -56.58 -50.02 73.17 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.852 0.861 . . . . 0.0 110.499 -179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.96 -46.16 88.74 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.303 1.041 . . . . 0.0 112.721 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -57.04 -45.05 83.47 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.37 -40.82 68.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 122.459 0.303 . . . . 0.0 111.726 176.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 m -61.79 -34.81 76.54 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.703 1.201 . . . . 0.0 113.578 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.75 -58.21 8.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.449 1.099 . . . . 0.0 109.905 176.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ttp-105 -61.46 -35.26 77.12 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.264 0.626 . . . . 0.0 111.664 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -56.25 -54.78 41.22 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.928 0.891 . . . . 0.0 112.234 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.88 -47.44 86.39 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 119.288 -0.386 . . . . 0.0 111.513 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -52.3 -36.0 51.89 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.19 0.596 . . . . 0.0 112.278 177.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.05 -31.62 65.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.049 0.939 . . . . 0.0 113.385 176.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' O ' HD23 ' A' ' 30' ' ' LEU . 6.0 tt -70.17 -23.58 63.0 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.297 -0.877 . . . . 0.0 111.974 176.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.7 t -85.73 4.61 3.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 125.062 1.345 . . . . 0.0 111.834 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -134.38 72.66 1.47 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 123.385 1.564 . . . . 0.0 111.243 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -127.75 60.0 1.45 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.034 1.333 . . . . 0.0 111.452 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -54.87 153.86 5.78 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.314 1.046 . . . . 0.0 111.152 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.8 mmm-85 -73.45 93.84 2.02 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.074 0.95 . . . . 0.0 110.676 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -85.54 -57.4 3.08 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.101 0.961 . . . . 0.0 112.131 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 O-C-N 119.122 -2.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.0 p90 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 119.203 -0.427 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -77.06 -25.36 8.84 Favored 'Trans proline' 0 N--CA 1.439 -1.726 0 C-N-CA 122.541 2.161 . . . . 0.0 109.943 -168.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.46 43.62 0.19 Allowed 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 127.938 2.495 . . . . 0.0 111.667 169.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -165.44 159.52 13.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 125.349 1.46 . . . . 0.0 110.209 -173.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.27 137.31 33.68 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 124.462 3.441 . . . . 0.0 108.071 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.22 145.86 53.9 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.118 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.52 138.17 94.92 Favored Pre-proline 0 N--CA 1.467 0.402 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -75.91 165.2 30.39 Favored 'Trans proline' 0 N--CA 1.424 -2.564 0 N-CA-C 108.649 -1.327 . . . . 0.0 108.649 -172.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.34 28.64 0.04 OUTLIER Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.785 -0.572 . . . . 0.0 113.95 -174.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -117.61 40.4 3.09 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.378 1.871 . . . . 0.0 109.232 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.1 t0 65.69 35.31 7.02 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 124.585 1.154 . . . . 0.0 111.961 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.55 141.1 51.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.55 2.34 . . . . 0.0 111.849 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p -64.71 152.42 90.15 Favored Pre-proline 0 N--CA 1.471 0.602 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 172.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -74.41 -31.14 7.53 Favored 'Trans proline' 0 N--CA 1.439 -1.688 0 C-N-CA 121.738 1.625 . . . . 0.0 112.245 -160.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.63 -25.94 67.59 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.125 169.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.71 -41.02 75.92 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.039 -1.663 . . . . 0.0 110.875 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -51.02 -50.32 58.77 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.486 1.914 . . . . 0.0 111.462 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 27.3 p -54.37 -47.45 72.62 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 125.172 1.389 . . . . 0.0 113.093 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -57.69 -50.19 74.03 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.682 1.593 . . . . 0.0 110.525 178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -51.9 -53.66 38.29 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.321 0.648 . . . . 0.0 111.277 173.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -55.94 -52.52 63.85 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.463 1.105 . . . . 0.0 112.997 -176.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 -49.64 71.87 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.16 0.584 . . . . 0.0 111.012 175.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 m -56.07 -40.68 73.95 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.178 0.991 . . . . 0.0 113.62 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -60.06 3.88 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.969 0.908 . . . . 0.0 110.949 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.8 mmm180 -63.32 -39.85 95.69 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.783 0.833 . . . . 0.0 111.787 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -56.69 16.26 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.734 0.814 . . . . 0.0 112.31 175.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -60.59 -46.94 88.37 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.2 0.454 . . . . 0.0 111.088 176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 31' ' ' VAL . 8.2 tt -54.24 -36.0 63.08 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 118.24 0.473 . . . . 0.0 111.823 177.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -57.76 -19.15 25.85 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 30' ' ' LEU . 5.7 tt -77.79 -23.16 49.23 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.93 1.292 . . . . 0.0 112.914 173.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 28' ' ' LEU . 1.2 p -86.19 5.96 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 CA-C-N 119.605 1.093 . . . . 0.0 113.1 178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.6 t -130.47 27.74 4.99 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.531 1.533 . . . . 0.0 112.268 -174.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -126.06 78.67 1.78 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.8 1.64 . . . . 0.0 113.392 -176.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.3 mm100 -102.45 21.03 15.89 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.023 1.729 . . . . 0.0 112.761 -178.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.76 21.37 7.67 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.08 1.752 . . . . 0.0 112.441 -175.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -136.35 105.92 6.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 122.267 1.032 . . . . 0.0 111.68 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.094 -1.628 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.4 p90 . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.177 -0.439 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.29 -23.65 8.63 Favored 'Trans proline' 0 N--CA 1.442 -1.554 0 C-N-CA 122.024 1.816 . . . . 0.0 110.212 -168.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.09 45.19 14.98 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 127.714 2.406 . . . . 0.0 113.679 174.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.1 144.3 0.1 Allowed Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 127.509 2.324 . . . . 0.0 111.183 -170.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.87 142.1 56.17 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.155 2.57 . . . . 0.0 108.615 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -70.33 161.38 30.51 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.384 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.36 142.34 68.66 Favored Pre-proline 0 CA--C 1.515 -0.386 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.584 ' HG3' HD13 ' A' ' 17' ' ' LEU . 96.3 Cg_endo -71.5 170.3 18.84 Favored 'Trans proline' 0 N--CA 1.427 -2.438 0 O-C-N 123.469 1.247 . . . . 0.0 110.621 -170.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.28 134.12 50.4 Favored Glycine 0 CA--C 1.535 1.289 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -56.78 -26.91 58.8 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 121.773 -0.84 . . . . 0.0 111.952 171.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -106.94 31.23 5.48 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 125.667 1.587 . . . . 0.0 111.904 173.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.08 153.31 22.79 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.686 1.595 . . . . 0.0 111.783 172.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 p -66.53 151.01 96.85 Favored Pre-proline 0 N--CA 1.471 0.618 0 N-CA-C 116.045 1.868 . . . . 0.0 116.045 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -73.66 -28.64 11.55 Favored 'Trans proline' 0 N--CA 1.438 -1.738 0 C-N-CA 122.203 1.935 . . . . 0.0 112.871 -164.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -64.59 -36.89 85.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.613 170.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -59.01 -47.91 83.48 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.814 0.845 . . . . 0.0 110.563 175.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.584 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -45.74 -49.45 14.82 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.174 1.79 . . . . 0.0 111.602 177.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.9 t -54.54 -52.88 60.65 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.292 1.437 . . . . 0.0 113.829 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 22.2 mtp180 -58.26 -42.41 86.4 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.042 1.337 . . . . 0.0 111.76 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -60.01 -52.28 66.07 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 122.95 0.5 . . . . 0.0 112.195 172.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -54.3 -49.86 68.67 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.634 0.774 . . . . 0.0 112.604 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.59 -40.78 79.82 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.8 m -62.77 -34.43 77.22 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 26.1 tp -56.84 -57.72 11.23 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.793 0.837 . . . . 0.0 111.665 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -57.82 -36.08 71.76 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.72 0.808 . . . . 0.0 111.738 175.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -56.02 -51.46 67.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.579 0.752 . . . . 0.0 112.619 177.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -60.52 -47.19 87.24 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 119.513 -0.279 . . . . 0.0 111.541 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.8 tm? -56.88 -35.14 68.58 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.222 0.464 . . . . 0.0 111.756 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -58.15 -23.08 53.88 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.35 -15.48 58.66 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 120.935 -1.103 . . . . 0.0 113.081 174.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -86.75 7.49 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.761 1.624 . . . . 0.0 111.748 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.5 t -132.5 24.04 4.4 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.298 1.439 . . . . 0.0 112.272 -176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 31.2 ptt85 -73.55 32.26 0.08 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.871 1.668 . . . . 0.0 114.104 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -105.98 177.01 4.98 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.74 1.216 . . . . 0.0 110.549 -178.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.0 21.0 13.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.725 2.01 . . . . 0.0 112.382 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -113.66 -74.24 0.63 Allowed 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 125.041 1.336 . . . . 0.0 110.101 -177.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 O-C-N 119.378 -2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 6.0 p90 . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 119.691 -0.195 . . . . 0.0 111.486 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.9 -20.91 11.4 Favored 'Trans proline' 0 N--CA 1.436 -1.859 0 C-N-CA 122.398 2.065 . . . . 0.0 109.695 -171.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.63 18.47 11.41 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 125.625 1.57 . . . . 0.0 112.526 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtmp? -85.51 156.81 59.04 Favored Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 126.301 1.84 . . . . 0.0 111.353 178.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -73.35 124.72 9.64 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 124.989 3.793 . . . . 0.0 107.476 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -68.28 157.37 35.73 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 118.821 -1.151 . . . . 0.0 110.751 178.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.09 142.95 64.87 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HG3' HD13 ' A' ' 17' ' ' LEU . 97.2 Cg_endo -72.36 170.52 19.04 Favored 'Trans proline' 0 N--CA 1.426 -2.452 0 O-C-N 122.828 0.909 . . . . 0.0 110.548 -172.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.07 136.36 40.46 Favored Glycine 0 CA--C 1.531 1.054 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 172.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.52 -27.26 66.02 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.509 -0.995 . . . . 0.0 112.056 173.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -101.97 18.87 19.57 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.428 2.291 . . . . 0.0 112.297 173.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.85 150.07 36.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.023 1.329 . . . . 0.0 112.019 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.95 153.92 78.58 Favored Pre-proline 0 N--CA 1.469 0.492 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 175.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -76.67 -32.9 3.32 Favored 'Trans proline' 0 N--CA 1.44 -1.661 0 C-N-CA 121.13 1.22 . . . . 0.0 111.954 -163.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -60.74 -36.38 78.74 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.523 170.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -62.79 -40.74 98.25 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.443 -0.786 . . . . 0.0 111.568 177.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.9 mm? -50.92 -45.61 60.47 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.918 1.687 . . . . 0.0 111.547 175.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.1 m -56.16 -52.85 62.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.827 1.251 . . . . 0.0 113.233 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 -54.45 -49.28 70.4 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.044 0.938 . . . . 0.0 110.767 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -54.73 -53.3 56.76 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.644 0.777 . . . . 0.0 112.537 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -56.91 -47.12 81.3 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.55 -46.6 80.61 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.552 0.741 . . . . 0.0 111.712 173.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.7 m -59.63 -33.65 71.78 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.53 -59.21 5.0 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.987 0.915 . . . . 0.0 110.738 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -60.91 -37.04 80.87 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.11 176.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -55.48 -55.89 26.59 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -61.01 -47.06 88.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 117.992 0.36 . . . . 0.0 111.438 175.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.551 ' HA ' HG12 ' A' ' 31' ' ' VAL . 11.6 tp -55.53 -31.73 62.36 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 119.165 -0.445 . . . . 0.0 111.484 179.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -63.99 -34.34 77.77 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.428 1.091 . . . . 0.0 112.751 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.2 tp -75.7 -38.88 58.25 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.882 0.873 . . . . 0.0 111.502 178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.551 HG12 ' HA ' ' A' ' 28' ' ' LEU . 3.8 p -80.76 2.41 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -124.07 -29.84 3.56 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.876 1.27 . . . . 0.0 114.107 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 58.09 44.02 19.91 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.842 1.257 . . . . 0.0 112.906 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 63.2 mt-30 -69.42 174.44 4.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.39 1.476 . . . . 0.0 112.105 176.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -138.87 42.45 2.11 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.729 1.612 . . . . 0.0 113.178 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -110.14 14.29 22.92 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.44 1.096 . . . . 0.0 113.041 -177.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.778 -2.451 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.1 p90 . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 119.338 -0.363 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -76.43 -21.12 13.55 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 122.357 2.038 . . . . 0.0 109.793 -169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.24 19.85 7.94 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.031 2.132 . . . . 0.0 113.014 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -112.74 81.77 4.58 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 126.402 1.881 . . . . 0.0 108.869 -176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.25 133.4 21.04 Favored 'Trans proline' 0 N--CA 1.447 -1.208 0 C-N-CA 123.903 3.068 . . . . 0.0 107.603 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.98 157.03 22.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.882 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.65 143.95 36.32 Favored Pre-proline 0 N--CA 1.475 0.787 0 O-C-N 120.51 -1.369 . . . . 0.0 114.619 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.86 168.88 23.69 Favored 'Trans proline' 0 N--CA 1.427 -2.391 0 N-CA-C 109.166 -1.128 . . . . 0.0 109.166 -171.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.86 -178.92 36.26 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.493 174.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -77.66 -21.64 51.83 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.006 0.922 . . . . 0.0 113.139 176.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -60.24 -49.45 77.58 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.47 1.108 . . . . 0.0 111.456 176.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.469 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -49.78 126.66 14.39 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.091 1.757 . . . . 0.0 111.525 172.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.15 153.34 18.86 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 176.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -76.74 -33.6 2.88 Favored 'Trans proline' 0 N--CA 1.432 -2.119 0 C-N-CA 121.991 1.794 . . . . 0.0 109.996 -161.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -69.63 -45.3 68.83 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.425 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.03 -39.14 71.53 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.176 0.898 . . . . 0.0 112.228 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -48.17 -30.67 4.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.27 1.828 . . . . 0.0 112.997 171.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.3 p -53.6 -52.38 59.99 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.98 1.264 . . . . 0.0 112.162 175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 53.1 mtp180 -63.4 -46.73 85.07 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.31 1.444 . . . . 0.0 110.632 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -60.48 -55.53 32.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.462 0.705 . . . . 0.0 112.167 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -58.3 -41.97 85.59 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.493 0.717 . . . . 0.0 112.497 177.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.9 -35.51 66.63 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 118.351 0.523 . . . . 0.0 112.405 175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.3 m -59.09 -34.29 71.83 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -57.61 -51.44 69.51 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.105 0.962 . . . . 0.0 110.946 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.4 tpp180 -60.29 -38.77 84.66 Favored 'General case' 0 C--N 1.342 0.28 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.992 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -55.11 -46.78 75.58 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.983 0.913 . . . . 0.0 113.067 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -63.68 -50.7 68.21 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 122.57 0.348 . . . . 0.0 111.51 174.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 tt -56.2 -31.69 63.69 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 122.941 0.497 . . . . 0.0 111.404 177.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.607 ' HA ' HG22 ' A' ' 32' ' ' THR . 31.8 t30 -65.33 -41.39 93.99 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.371 1.068 . . . . 0.0 112.642 176.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.9 -22.11 66.77 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.51 -0.744 . . . . 0.0 112.256 177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.91 12.42 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 125.388 1.475 . . . . 0.0 113.232 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.607 HG22 ' HA ' ' A' ' 29' ' ' ASN . 0.9 OUTLIER -125.41 1.33 7.69 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.212 1.005 . . . . 0.0 113.183 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.44 28.16 0.66 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.692 1.597 . . . . 0.0 113.802 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -114.8 169.38 9.11 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.922 1.289 . . . . 0.0 110.278 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? 59.13 25.05 13.46 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.657 1.183 . . . . 0.0 112.833 -176.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -83.0 -71.11 0.51 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.312 1.045 . . . . 0.0 110.822 177.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.471 0 O-C-N 119.154 -2.216 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -80.49 -22.74 6.53 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.399 2.066 . . . . 0.0 110.381 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.21 19.71 3.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.919 2.488 . . . . 0.0 114.62 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HD3' HD12 ' A' ' 24' ' ' LEU . 16.5 mttt -103.03 157.83 32.96 Favored Pre-proline 0 N--CA 1.452 -0.367 0 C-N-CA 126.818 2.047 . . . . 0.0 111.647 -177.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.19 129.86 18.98 Favored 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 124.448 3.432 . . . . 0.0 107.56 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.82 155.38 34.16 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 118.779 -1.169 . . . . 0.0 110.338 176.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.54 144.03 73.39 Favored Pre-proline 0 N--CA 1.466 0.362 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 176.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -72.61 168.98 22.98 Favored 'Trans proline' 0 N--CA 1.428 -2.371 0 O-C-N 123.109 1.057 . . . . 0.0 109.541 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.27 139.4 44.14 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 120.982 -0.628 . . . . 0.0 111.876 172.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -62.38 -20.56 64.55 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 121.669 -0.901 . . . . 0.0 112.653 172.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -106.35 20.4 19.03 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 126.352 1.861 . . . . 0.0 111.414 172.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.6 154.74 28.51 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.122 1.369 . . . . 0.0 111.55 174.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.7 p -67.57 158.81 81.35 Favored Pre-proline 0 N--CA 1.47 0.561 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 173.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -75.73 -29.79 6.78 Favored 'Trans proline' 0 N--CA 1.441 -1.578 0 C-N-CA 121.531 1.488 . . . . 0.0 112.125 -164.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -61.88 -34.1 75.4 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.447 172.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -62.67 -35.25 79.06 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 123.063 0.545 . . . . 0.0 112.003 173.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -65.94 -45.77 80.61 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.992 1.717 . . . . 0.0 110.542 177.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 63.8 m -55.53 -64.43 0.85 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.864 1.666 . . . . 0.0 113.717 178.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -39.41 65.6 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.057 0.943 . . . . 0.0 112.087 177.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -60.24 -54.57 44.19 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.17 0.988 . . . . 0.0 111.28 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -56.68 -49.86 73.85 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.444 0.698 . . . . 0.0 112.473 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -44.16 92.24 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -58.38 -36.73 73.96 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.246 1.018 . . . . 0.0 113.727 176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.408 HD12 ' HD3' ' A' ' 4' ' ' LYS . 21.9 tp -54.01 -53.32 54.65 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.401 0.68 . . . . 0.0 111.578 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 59.2 ttp180 -60.49 -43.45 96.99 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.545 0.738 . . . . 0.0 111.009 172.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -52.19 -54.3 32.54 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -61.71 -46.52 89.31 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 19.0 tp -50.89 -41.09 58.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 118.606 -0.711 . . . . 0.0 111.272 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -55.72 -33.78 64.54 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 tp -60.96 -32.68 72.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.169 -0.957 . . . . 0.0 111.639 175.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.87 4.76 3.78 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 125.623 1.569 . . . . 0.0 111.52 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.7 p -127.76 85.41 2.35 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 122.77 1.272 . . . . 0.0 111.263 -176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.5 mtm180 -128.1 63.45 1.41 Allowed 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.242 1.017 . . . . 0.0 110.981 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -60.76 172.88 0.84 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.166 0.987 . . . . 0.0 112.315 171.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.7 91.19 3.11 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 124.476 1.11 . . . . 0.0 109.798 -174.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -114.62 -51.17 2.76 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.199 1.0 . . . . 0.0 110.747 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 O-C-N 119.509 -1.994 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.5 p90 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.161 -0.447 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -76.56 -28.09 7.01 Favored 'Trans proline' 0 N--CA 1.44 -1.659 0 C-N-CA 121.888 1.725 . . . . 0.0 109.789 -170.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.72 18.31 10.52 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 127.986 2.514 . . . . 0.0 114.455 176.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.6 mtmm 76.5 156.59 0.15 Allowed Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 128.548 2.739 . . . . 0.0 110.449 -173.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -69.64 132.19 23.0 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.166 2.578 . . . . 0.0 107.663 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -67.92 156.98 36.01 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.1 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.15 143.15 45.16 Favored Pre-proline 0 N--CA 1.467 0.415 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.611 ' HG3' HD13 ' A' ' 17' ' ' LEU . 98.8 Cg_endo -71.63 169.22 21.57 Favored 'Trans proline' 0 N--CA 1.428 -2.381 0 O-C-N 123.02 1.01 . . . . 0.0 109.8 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.72 136.2 38.57 Favored Glycine 0 CA--C 1.531 1.045 0 C-N-CA 120.406 -0.902 . . . . 0.0 111.416 172.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -57.57 -22.88 47.57 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 121.546 -0.973 . . . . 0.0 112.729 171.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -106.41 15.84 25.49 Favored 'General case' 0 CA--C 1.559 1.298 0 C-N-CA 126.492 1.917 . . . . 0.0 111.139 177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 152.13 35.38 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.831 2.052 . . . . 0.0 112.492 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.3 p -67.44 152.03 96.59 Favored Pre-proline 0 N--CA 1.474 0.762 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 175.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -73.16 -32.2 8.71 Favored 'Trans proline' 0 N--CA 1.441 -1.586 0 C-N-CA 122.509 2.139 . . . . 0.0 112.144 -163.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -62.91 -30.79 71.81 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.768 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -62.71 -45.25 93.61 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.31 -0.869 . . . . 0.0 110.676 173.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.611 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.4 mm? -50.93 -47.02 61.11 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.931 2.092 . . . . 0.0 110.753 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.8 t -55.05 -53.72 52.22 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.59 1.156 . . . . 0.0 113.257 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 73.3 mtt85 -54.64 -49.03 71.53 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.861 0.864 . . . . 0.0 110.696 178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.24 -55.62 29.28 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.885 0.874 . . . . 0.0 112.615 176.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.91 -51.28 68.15 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.17 -47.5 78.17 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.184 0.593 . . . . 0.0 111.854 175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 m -56.45 -37.3 70.09 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.02 -56.16 22.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.589 0.756 . . . . 0.0 110.837 178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 69.1 mmt-85 -61.21 -37.09 81.77 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.772 0.829 . . . . 0.0 111.547 177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -56.21 -53.27 59.15 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.296 1.038 . . . . 0.0 112.33 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -62.27 -48.11 81.35 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 119.019 -0.515 . . . . 0.0 111.089 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.14 -39.38 59.86 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-O 118.758 -0.639 . . . . 0.0 111.691 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -52.69 -36.31 56.97 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.048 0.84 . . . . 0.0 113.112 177.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.7 tp -59.76 -26.19 65.49 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.126 0.875 . . . . 0.0 113.034 176.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.9 m -112.37 -1.15 9.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 126.449 1.9 . . . . 0.0 113.28 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.8 p -127.69 8.3 6.34 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.659 1.584 . . . . 0.0 113.575 -177.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ptt180 -74.85 29.35 0.09 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.884 2.074 . . . . 0.0 114.504 176.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -84.11 179.42 7.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.895 0.878 . . . . 0.0 111.515 175.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 48.3 mmm-85 -108.2 -21.93 12.57 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 117.319 -1.324 . . . . 0.0 114.126 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 p90 44.16 2.26 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 128.606 2.763 . . . . 0.0 117.271 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 118.38 -2.7 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.5 p90 . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 118.989 -0.529 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -76.25 -25.7 9.72 Favored 'Trans proline' 0 N--CA 1.444 -1.437 0 C-N-CA 122.652 2.235 . . . . 0.0 110.095 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.34 38.76 5.62 Favored 'General case' 0 N--CA 1.441 -0.905 0 C-N-CA 127.089 2.156 . . . . 0.0 112.601 169.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 70.33 143.81 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 128.5 2.72 . . . . 0.0 111.857 -168.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.94 123.99 10.58 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 124.146 3.231 . . . . 0.0 108.618 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -62.09 144.22 55.58 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.408 -177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.87 143.59 69.98 Favored Pre-proline 0 N--CA 1.47 0.569 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -176.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -78.82 167.78 21.82 Favored 'Trans proline' 0 N--CA 1.425 -2.515 0 N-CA-C 108.64 -1.331 . . . . 0.0 108.64 -170.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.47 35.67 0.04 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.68 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -116.37 36.61 4.03 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.358 1.463 . . . . 0.0 111.622 -177.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 69.22 32.57 3.58 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.869 0.868 . . . . 0.0 110.752 -176.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.703 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -74.99 138.81 42.5 Favored 'General case' 0 CA--C 1.563 1.449 0 C-N-CA 128.059 2.544 . . . . 0.0 111.537 179.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.82 152.18 93.63 Favored Pre-proline 0 N--CA 1.48 1.044 0 N-CA-C 115.727 1.751 . . . . 0.0 115.727 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -72.39 -40.18 2.41 Favored 'Trans proline' 0 N--CA 1.441 -1.567 0 C-N-CA 122.486 2.124 . . . . 0.0 111.108 -156.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.32 -47.62 85.26 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.832 1.653 . . . . 0.0 111.728 173.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.01 -45.11 96.13 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.425 1.09 . . . . 0.0 110.465 176.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.703 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -46.96 -48.32 21.61 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.897 2.479 . . . . 0.0 111.351 175.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.3 m -55.86 -57.85 10.35 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.965 1.306 . . . . 0.0 113.107 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -56.3 -50.79 70.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.824 0.85 . . . . 0.0 110.47 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -55.19 -49.12 72.7 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.019 0.927 . . . . 0.0 112.943 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -57.27 -46.47 83.05 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.76 -39.12 68.03 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.542 0.337 . . . . 0.0 111.812 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -59.52 -34.74 73.01 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.445 1.098 . . . . 0.0 113.474 176.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -59.51 4.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.357 1.063 . . . . 0.0 109.689 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -59.26 -38.31 79.77 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.884 0.874 . . . . 0.0 111.031 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -55.53 -53.09 60.74 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.668 0.787 . . . . 0.0 112.62 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -64.03 -45.05 90.6 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 119.153 -0.451 . . . . 0.0 110.9 173.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tt -50.7 -45.93 58.57 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.719 -0.658 . . . . 0.0 110.521 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -48.46 -27.18 2.5 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.178 1.391 . . . . 0.0 114.098 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.8 tt -58.6 -46.26 87.4 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.586 1.154 . . . . 0.0 112.143 174.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.5 p -84.3 -3.2 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.048 0.939 . . . . 0.0 112.819 177.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -130.52 76.88 1.75 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 125.91 1.684 . . . . 0.0 111.431 -176.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -118.86 62.08 0.79 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.639 1.576 . . . . 0.0 110.364 174.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -56.53 154.66 8.3 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.818 0.818 . . . . 0.0 111.511 171.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.82 22.03 11.71 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 125.77 1.628 . . . . 0.0 111.87 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.02 142.92 58.19 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 122.241 1.02 . . . . 0.0 111.547 -178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 119.74 -1.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.4 p90 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -77.58 -26.42 7.13 Favored 'Trans proline' 0 N--CA 1.44 -1.636 0 C-N-CA 121.86 1.707 . . . . 0.0 109.883 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 55.33 25.67 7.8 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 127.553 2.341 . . . . 0.0 113.463 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.6 mtmp? -140.62 159.6 62.26 Favored Pre-proline 0 N--CA 1.452 -0.326 0 C-N-CA 126.033 1.733 . . . . 0.0 111.489 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.16 143.14 48.01 Favored 'Trans proline' 0 N--CA 1.447 -1.217 0 C-N-CA 124.265 3.31 . . . . 0.0 108.048 178.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -69.07 155.45 40.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.281 175.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.21 141.63 50.65 Favored Pre-proline 0 C--O 1.237 0.444 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.545 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.1 166.75 28.72 Favored 'Trans proline' 0 N--CA 1.426 -2.449 0 O-C-N 123.57 1.3 . . . . 0.0 109.52 -171.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -62.71 137.8 44.51 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 173.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -59.34 -26.3 64.92 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.682 -0.893 . . . . 0.0 112.057 171.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -103.37 22.48 14.12 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.732 1.613 . . . . 0.0 111.613 173.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.42 149.61 33.25 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.917 1.287 . . . . 0.0 111.315 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -67.06 150.09 98.12 Favored Pre-proline 0 N--CA 1.468 0.439 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 174.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -74.02 -32.14 7.3 Favored 'Trans proline' 0 N--CA 1.444 -1.435 0 C-N-CA 122.948 2.432 . . . . 0.0 112.607 -160.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -58.61 -35.38 72.37 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.486 169.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -62.93 -40.73 98.5 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.989 0.916 . . . . 0.0 111.212 177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.545 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.5 mm? -54.0 -44.05 70.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.752 2.021 . . . . 0.0 110.728 177.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.5 t -56.68 -54.75 42.56 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.038 1.335 . . . . 0.0 113.066 175.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -53.27 -49.43 66.94 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.009 0.924 . . . . 0.0 110.754 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -55.02 -58.16 8.79 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.572 0.749 . . . . 0.0 111.812 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -55.49 -48.44 74.59 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -178.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.99 -46.02 90.83 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 122.924 0.49 . . . . 0.0 111.245 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.42 -39.92 61.56 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.307 1.043 . . . . 0.0 113.455 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 47.1 mt -55.13 -48.09 74.15 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 118.613 0.642 . . . . 0.0 112.19 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -62.04 -43.22 99.31 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.863 0.865 . . . . 0.0 110.839 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -55.23 -50.64 68.92 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.912 0.885 . . . . 0.0 111.795 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -58.55 -52.74 64.38 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 173.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.0 tt -55.92 -36.09 67.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 122.573 0.349 . . . . 0.0 111.123 -178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -59.19 -40.57 86.12 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.364 1.066 . . . . 0.0 112.643 176.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tt -54.74 -46.36 74.25 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.907 0.883 . . . . 0.0 111.095 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.8 p -88.15 10.43 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 124.671 1.188 . . . . 0.0 113.352 175.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 19.9 m -132.24 84.39 2.15 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 123.397 1.57 . . . . 0.0 111.693 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -125.89 80.63 1.92 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 126.035 1.734 . . . . 0.0 109.893 177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.88 156.64 26.98 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.738 0.78 . . . . 0.0 111.163 172.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 26.4 ptt-85 -133.03 50.85 2.2 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.073 1.349 . . . . 0.0 111.598 -176.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -61.59 12.08 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 117.742 -3.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.6 p90 . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 111.83 0.307 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -80.28 -9.54 13.84 Favored 'Trans proline' 0 N--CA 1.438 -1.793 0 C-N-CA 123.127 2.551 . . . . 0.0 110.34 -173.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 64.85 19.71 11.92 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 127.86 2.464 . . . . 0.0 114.195 173.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? -120.76 138.11 27.23 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 128.063 2.545 . . . . 0.0 109.475 -174.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -68.28 130.02 20.39 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 125.035 3.823 . . . . 0.0 108.503 178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -69.37 159.52 33.03 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.653 177.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.43 143.59 65.77 Favored Pre-proline 0 N--CA 1.468 0.455 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 177.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -72.34 168.94 22.86 Favored 'Trans proline' 0 N--CA 1.427 -2.411 0 O-C-N 123.144 1.076 . . . . 0.0 109.801 -173.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.28 137.19 50.29 Favored Glycine 0 CA--C 1.536 1.386 0 N-CA-C 111.731 -0.548 . . . . 0.0 111.731 171.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -57.74 -28.39 63.86 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.537 0.735 . . . . 0.0 111.624 172.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -104.22 22.94 13.88 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 127.486 2.315 . . . . 0.0 111.927 174.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.4 149.86 28.64 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.949 1.3 . . . . 0.0 112.123 173.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.5 p -65.7 153.51 90.68 Favored Pre-proline 0 N--CA 1.474 0.727 0 N-CA-C 116.687 2.106 . . . . 0.0 116.687 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -71.81 -29.66 15.22 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 122.627 2.218 . . . . 0.0 113.293 -163.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -60.92 -34.27 74.42 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.542 171.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -63.2 -37.6 87.86 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.269 -0.895 . . . . 0.0 110.98 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.53 -48.48 81.6 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.029 1.732 . . . . 0.0 110.522 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.8 t -51.61 -63.54 1.1 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.758 1.623 . . . . 0.0 113.357 176.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 33.5 ptt85 -54.09 -40.46 67.27 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.698 0.799 . . . . 0.0 112.461 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -60.8 -53.06 61.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.823 1.249 . . . . 0.0 111.521 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -53.41 -48.76 68.42 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.827 0.851 . . . . 0.0 112.125 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.2 -43.51 92.25 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 122.675 0.39 . . . . 0.0 111.892 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.0 m -65.7 -30.37 71.04 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.59 -59.25 5.27 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.02 0.827 . . . . 0.0 110.782 176.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 tpt180 -57.25 -37.78 72.85 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.092 0.557 . . . . 0.0 110.938 176.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -55.57 -47.26 76.71 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.776 0.83 . . . . 0.0 113.161 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -64.09 -50.59 67.7 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.113 0.565 . . . . 0.0 111.279 174.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.41 -30.58 52.81 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.594 ' HA ' HG22 ' A' ' 32' ' ' THR . 24.6 t30 -66.11 -33.85 76.71 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.761 0.824 . . . . 0.0 112.933 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.4 tp -70.85 -27.61 63.98 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.283 1.033 . . . . 0.0 112.121 178.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.5 m -97.48 3.32 10.09 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.026 1.331 . . . . 0.0 113.361 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.594 HG22 ' HA ' ' A' ' 29' ' ' ASN . 1.4 t -123.77 4.95 8.8 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.023 1.329 . . . . 0.0 112.996 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 52.69 29.74 7.81 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.193 1.797 . . . . 0.0 113.694 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 60.71 20.3 10.33 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.648 1.579 . . . . 0.0 114.58 -172.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 13.7 mmt85 -92.8 79.78 4.71 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.155 1.382 . . . . 0.0 111.008 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 57.8 22.68 8.8 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.285 1.034 . . . . 0.0 113.566 177.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 119.151 -2.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.533 ' HD1' ' HB2' ' A' ' 3' ' ' ALA . 16.0 p90 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.306 -0.378 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.76 -32.94 5.34 Favored 'Trans proline' 0 N--CA 1.437 -1.821 0 C-N-CA 121.976 1.784 . . . . 0.0 108.835 -168.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.533 ' HB2' ' HD1' ' A' ' 1' ' ' TYR . . . 63.41 20.92 12.53 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.606 2.362 . . . . 0.0 113.156 175.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -130.2 143.62 49.92 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.993 2.517 . . . . 0.0 108.43 -176.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.6 140.9 33.52 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 124.55 3.5 . . . . 0.0 108.928 176.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -70.92 162.85 28.6 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.415 -0.914 . . . . 0.0 111.741 176.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.99 36.22 Favored Pre-proline 0 N--CA 1.465 0.324 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.8 Cg_endo -71.66 169.46 21.0 Favored 'Trans proline' 0 N--CA 1.429 -2.315 0 O-C-N 123.225 1.118 . . . . 0.0 110.068 -171.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.23 136.24 49.71 Favored Glycine 0 CA--C 1.533 1.204 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 172.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -61.19 -24.71 66.51 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.895 -0.767 . . . . 0.0 112.289 174.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -103.31 17.85 23.13 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 126.591 1.956 . . . . 0.0 111.787 174.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.47 155.39 36.29 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.611 1.565 . . . . 0.0 112.153 174.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.37 150.27 91.68 Favored Pre-proline 0 N--CA 1.466 0.372 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -73.39 -32.62 7.88 Favored 'Trans proline' 0 N--CA 1.441 -1.587 0 C-N-CA 121.775 1.65 . . . . 0.0 112.795 -161.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -60.73 -34.96 75.18 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.599 170.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -61.74 -43.6 98.53 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.078 0.951 . . . . 0.0 110.992 175.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -50.63 -50.38 54.45 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.449 1.9 . . . . 0.0 110.108 176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -54.12 -53.45 53.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.657 1.183 . . . . 0.0 113.841 176.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.9 mtp-105 -53.81 -45.76 70.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.567 1.147 . . . . 0.0 111.793 176.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -58.62 -54.21 49.69 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.922 0.889 . . . . 0.0 112.147 175.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -54.12 -51.02 65.54 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.742 0.817 . . . . 0.0 112.518 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.66 -41.48 86.23 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -64.42 -35.31 80.49 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 176.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -56.22 -54.61 43.23 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.753 0.706 . . . . 0.0 111.734 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -60.28 -37.81 81.63 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.175 0.59 . . . . 0.0 111.123 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -53.1 -51.19 62.67 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.041 0.936 . . . . 0.0 112.409 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -60.18 -47.79 84.45 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 173.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.1 tm? -54.35 -36.95 64.37 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.057 0.543 . . . . 0.0 111.626 -179.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.41 -24.97 48.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.285 1.034 . . . . 0.0 113.674 175.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 tt -79.24 -20.28 48.57 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 112.683 174.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.0 t -82.5 3.81 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 126.132 1.773 . . . . 0.0 111.627 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -132.6 67.01 1.54 Allowed 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.788 1.635 . . . . 0.0 110.873 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.2 ptt85 -129.95 9.78 5.39 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -71.55 101.48 2.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.923 1.289 . . . . 0.0 110.201 -178.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 58.62 23.9 11.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.796 1.238 . . . . 0.0 112.659 178.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -71.44 157.81 37.38 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.323 1.049 . . . . 0.0 112.061 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 119.757 -1.839 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.9 p90 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 119.138 -0.458 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -76.94 -18.28 14.82 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 122.781 2.321 . . . . 0.0 110.097 -170.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.48 28.09 2.93 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 127.504 2.321 . . . . 0.0 112.619 169.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HG2' ' CD1' ' A' ' 27' ' ' TYR . 23.7 mttt 75.34 157.77 0.16 Allowed Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 129.37 3.068 . . . . 0.0 110.132 -175.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -70.52 145.83 53.84 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.599 2.199 . . . . 0.0 107.938 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -64.9 146.25 55.19 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.872 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.03 138.36 91.01 Favored Pre-proline 0 CA--C 1.512 -0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.401 ' HD3' ' CG ' ' A' ' 20' ' ' TYR . 23.7 Cg_endo -75.47 173.86 13.79 Favored 'Trans proline' 0 N--CA 1.418 -2.912 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 -174.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 155.34 -133.28 3.71 Favored Glycine 0 C--O 1.219 -0.782 0 N-CA-C 106.607 -2.597 . . . . 0.0 106.607 -176.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 45.79 30.42 0.84 Allowed 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.241 1.52 . . . . 0.0 114.777 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 0.258 38.7 m-20 60.89 47.27 7.82 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 125.546 1.538 . . . . 0.0 113.39 -169.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.89 141.48 51.19 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 128.833 2.853 . . . . 0.0 111.9 172.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.5 p -65.88 149.28 97.7 Favored Pre-proline 0 N--CA 1.467 0.383 0 N-CA-C 116.151 1.908 . . . . 0.0 116.151 173.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -72.77 -31.14 10.75 Favored 'Trans proline' 0 N--CA 1.438 -1.745 0 C-N-CA 122.156 1.904 . . . . 0.0 112.68 -162.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.65 -33.69 76.19 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.885 174.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -63.07 -45.85 90.22 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.067 1.347 . . . . 0.0 110.789 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -49.43 -49.94 42.89 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.775 2.03 . . . . 0.0 110.797 176.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -58.28 -48.74 79.5 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 51.3 mtp180 -58.95 -44.69 91.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.387 0.675 . . . . 0.0 112.208 177.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.401 ' CG ' ' HD3' ' A' ' 8' ' ' PRO . 58.6 t80 -56.68 -51.49 68.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.104 0.562 . . . . 0.0 111.561 173.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -53.25 -53.11 55.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.297 1.039 . . . . 0.0 113.306 -177.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.18 -45.97 75.79 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.84 0.456 . . . . 0.0 111.614 175.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 m -58.55 -40.97 84.53 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.573 179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.2 -59.8 4.27 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.704 1.202 . . . . 0.0 110.639 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -63.83 -38.88 92.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 118.502 -0.761 . . . . 0.0 111.527 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -51.72 -58.06 7.46 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.031 0.933 . . . . 0.0 111.996 174.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE1' HG21 ' A' ' 31' ' ' VAL . 44.2 t80 -63.53 -47.53 81.25 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.051 -0.499 . . . . 0.0 111.717 176.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 9.8 tp -50.03 -48.99 52.39 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.846 0.748 . . . . 0.0 110.659 178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -55.64 -43.86 76.61 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.407 0.683 . . . . 0.0 111.818 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -56.94 -31.68 65.21 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 125.717 1.607 . . . . 0.0 113.528 174.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' CE1' ' A' ' 27' ' ' TYR . 3.0 t -88.52 3.91 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.421 1.088 . . . . 0.0 112.318 177.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.3 p -123.18 -44.68 2.15 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.322 -0.861 . . . . 0.0 112.398 -177.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.7 mmt85 50.26 27.62 2.75 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.863 1.665 . . . . 0.0 112.962 -175.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -67.04 168.23 10.43 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 122.419 1.104 . . . . 0.0 112.173 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.0 ptt180 -110.89 20.28 17.69 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 126.301 1.84 . . . . 0.0 113.155 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -115.8 24.24 11.66 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.415 1.486 . . . . 0.0 112.406 -178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.54 0 O-C-N 118.581 -2.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 3' ' ' ALA . 2.8 p90 . . . . . 0 CA--C 1.497 -1.08 0 CA-C-O 118.817 -0.611 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -75.25 -15.36 20.26 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 O-C-N 124.486 1.782 . . . . 0.0 110.605 -176.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.414 ' HB3' ' CD1' ' A' ' 1' ' ' TYR . . . -59.8 167.42 2.15 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 124.668 1.187 . . . . 0.0 111.725 -176.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.6 mtmm -58.22 151.33 47.99 Favored Pre-proline 0 N--CA 1.47 0.569 0 O-C-N 121.379 -0.826 . . . . 0.0 113.041 176.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.15 149.92 85.33 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 123.916 3.077 . . . . 0.0 108.354 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -71.16 152.99 42.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.091 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -55.13 144.23 50.62 Favored Pre-proline 0 C--O 1.237 0.433 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 176.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.575 ' HG3' HD13 ' A' ' 17' ' ' LEU . 95.4 Cg_endo -71.96 171.79 15.94 Favored 'Trans proline' 0 N--CA 1.428 -2.345 0 O-C-N 123.087 1.046 . . . . 0.0 109.931 -173.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.5 137.69 37.55 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.57 172.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -57.86 -25.54 60.86 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.513 -0.992 . . . . 0.0 112.749 170.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -103.37 20.16 18.32 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.29 1.836 . . . . 0.0 111.75 175.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.95 152.39 31.09 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.737 1.615 . . . . 0.0 112.949 175.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -68.09 149.41 98.16 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 116.033 1.864 . . . . 0.0 116.033 175.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -71.78 -27.55 17.92 Favored 'Trans proline' 0 N--CA 1.44 -1.665 0 C-N-CA 122.205 1.937 . . . . 0.0 113.74 -163.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.98 -36.13 83.42 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.534 0.733 . . . . 0.0 111.243 170.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -60.71 -44.5 96.5 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.801 0.84 . . . . 0.0 110.495 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.575 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.0 mm? -49.65 -49.57 46.7 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.89 1.676 . . . . 0.0 110.666 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -56.44 -53.02 62.36 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.582 1.153 . . . . 0.0 113.447 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 59.7 mtp85 -52.29 -51.14 60.26 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.282 1.033 . . . . 0.0 110.804 176.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.39 -50.94 68.42 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.029 0.932 . . . . 0.0 112.756 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -56.24 -48.52 76.35 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.986 0.514 . . . . 0.0 112.342 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.38 75.69 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.281 0.632 . . . . 0.0 112.153 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.9 m -53.67 -34.61 59.26 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -53.39 -57.58 10.13 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.74 0.816 . . . . 0.0 109.979 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -62.87 -40.27 97.0 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.198 0.999 . . . . 0.0 111.158 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -54.2 -55.24 29.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 119.232 0.924 . . . . 0.0 112.233 178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -62.46 -44.78 95.57 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.038 0.381 . . . . 0.0 111.533 174.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.481 ' HA ' HG12 ' A' ' 31' ' ' VAL . 3.4 tt -57.47 -31.0 65.53 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.301 -0.249 . . . . 0.0 111.397 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -66.55 -30.09 70.32 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.022 0.929 . . . . 0.0 112.893 174.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.1 tp -74.09 -41.93 60.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.624 1.102 . . . . 0.0 111.282 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG12 ' HA ' ' A' ' 28' ' ' LEU . 4.2 p -79.94 12.18 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.714 1.206 . . . . 0.0 113.926 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.6 t -130.63 14.04 5.42 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.333 1.053 . . . . 0.0 113.065 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -97.96 69.29 2.06 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.111 1.364 . . . . 0.0 111.277 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.25 178.86 8.13 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.011 172.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.8 mmm-85 -132.32 108.04 8.94 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.864 1.266 . . . . 0.0 109.277 179.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.8 t80 -60.46 80.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 123.164 1.459 . . . . 0.0 112.371 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.712 0 O-C-N 119.646 -1.909 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 N--CA 1.478 0.945 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.68 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -10.13 13.9 Favored 'Trans proline' 0 N--CA 1.44 -1.667 0 C-N-CA 123.165 2.577 . . . . 0.0 110.69 -174.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 59.6 20.22 8.79 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 127.987 2.515 . . . . 0.0 113.797 174.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -128.71 139.38 35.43 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.844 2.458 . . . . 0.0 109.198 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.53 130.13 20.3 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 124.902 3.735 . . . . 0.0 108.333 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -61.87 144.42 54.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 119.899 -0.72 . . . . 0.0 110.594 179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.65 141.25 73.49 Favored Pre-proline 0 N--CA 1.468 0.433 0 C-N-CA 124.007 0.923 . . . . 0.0 113.024 -177.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -78.11 170.1 19.27 Favored 'Trans proline' 0 N--CA 1.424 -2.587 0 N-CA-C 108.27 -1.473 . . . . 0.0 108.27 -168.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.33 23.72 0.08 OUTLIER Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.589 -0.732 . . . . 0.0 113.426 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -107.15 33.89 3.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.73 1.612 . . . . 0.0 111.492 -177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 71.75 33.13 1.81 Allowed 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 124.517 1.127 . . . . 0.0 110.918 -176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.12 147.7 52.79 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 128.587 2.755 . . . . 0.0 112.339 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.31 154.54 94.83 Favored Pre-proline 0 N--CA 1.48 1.031 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -73.61 -34.22 5.85 Favored 'Trans proline' 0 N--CA 1.435 -1.942 0 C-N-CA 121.265 1.31 . . . . 0.0 111.516 -166.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -66.22 -39.07 89.32 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.594 169.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -58.01 -41.46 83.16 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 119.428 1.013 . . . . 0.0 111.409 173.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD12 ' CE2' ' A' ' 21' ' ' TYR . 0.4 OUTLIER -50.06 -42.47 49.92 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 125.197 1.399 . . . . 0.0 111.845 177.253 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.3 m -57.53 -70.44 0.13 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.638 1.575 . . . . 0.0 114.038 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -42.49 64.55 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.419 1.087 . . . . 0.0 111.884 178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.82 -54.65 43.74 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.247 1.019 . . . . 0.0 112.317 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.568 ' CE2' HD12 ' A' ' 17' ' ' LEU . 8.8 m-85 -58.36 -43.32 88.36 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 176.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.92 -38.59 70.48 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 118.285 0.493 . . . . 0.0 112.036 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -61.2 -36.26 79.41 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.479 1.111 . . . . 0.0 113.589 176.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.34 -56.4 20.57 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.738 0.815 . . . . 0.0 109.783 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -58.79 -38.54 78.8 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 118.424 -0.798 . . . . 0.0 111.077 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 21.6 t60 -53.61 -50.07 66.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.86 0.864 . . . . 0.0 113.099 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.56 ' CE2' HG21 ' A' ' 31' ' ' VAL . 92.2 t80 -62.62 -55.21 29.12 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.404 0.282 . . . . 0.0 111.268 174.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -50.99 -41.89 59.9 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.815 0.846 . . . . 0.0 112.114 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 2.3 m120 -56.61 -36.7 69.74 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.65 1.58 . . . . 0.0 113.713 175.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.1 tt -75.6 -36.82 60.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.579 1.151 . . . . 0.0 110.998 175.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG21 ' CE2' ' A' ' 27' ' ' TYR . 3.9 t -81.38 -1.64 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.757 0.823 . . . . 0.0 112.954 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 3.0 t -122.27 12.65 10.25 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.571 1.549 . . . . 0.0 113.113 -177.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -61.73 82.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.703 1.601 . . . . 0.0 111.479 177.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 60.21 38.34 20.12 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.702 1.601 . . . . 0.0 112.311 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.4 mmm-85 -104.94 9.68 34.52 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.423 1.089 . . . . 0.0 113.647 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -157.48 163.91 37.97 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.092 0.957 . . . . 0.0 111.071 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 O-C-N 120.093 -1.63 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 19.7 p90 . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 119.223 -0.417 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -75.96 -21.02 14.5 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 122.367 2.045 . . . . 0.0 109.927 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 63.02 25.27 14.95 Favored 'General case' 0 N--CA 1.439 -0.999 0 C-N-CA 127.953 2.501 . . . . 0.0 113.365 172.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.423 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.8 OUTLIER 62.88 164.8 0.11 Allowed Pre-proline 0 CA--C 1.551 0.993 0 C-N-CA 129.637 3.175 . . . . 0.0 113.038 -170.477 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.423 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 51.4 Cg_endo -73.79 119.35 5.85 Favored 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.402 2.735 . . . . 0.0 108.134 177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -60.11 144.0 50.82 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 120.448 -0.501 . . . . 0.0 111.257 -177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.58 141.37 55.27 Favored Pre-proline 0 N--CA 1.468 0.456 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -176.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -76.63 173.48 14.41 Favored 'Trans proline' 0 N--CA 1.422 -2.689 0 N-CA-C 108.836 -1.255 . . . . 0.0 108.836 -169.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 156.11 -134.85 4.26 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 107.587 -2.205 . . . . 0.0 107.587 -178.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 46.32 44.21 12.32 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 118.13 0.965 . . . . 0.0 112.019 -176.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 56.89 43.36 24.96 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 124.813 1.245 . . . . 0.0 113.043 -174.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.697 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -73.12 140.67 47.27 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 126.422 1.889 . . . . 0.0 112.024 176.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.8 p -69.2 149.1 97.6 Favored Pre-proline 0 N--CA 1.48 1.055 0 N-CA-C 115.895 1.813 . . . . 0.0 115.895 -178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -70.4 -37.56 7.49 Favored 'Trans proline' 0 N--CA 1.439 -1.701 0 C-N-CA 122.717 2.278 . . . . 0.0 111.765 -157.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -61.12 -52.76 63.54 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.529 1.532 . . . . 0.0 110.637 174.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -56.59 -47.25 79.97 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.248 1.019 . . . . 0.0 110.022 175.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.697 HD21 ' HB3' ' A' ' 12' ' ' ALA . 0.8 OUTLIER -46.13 -52.36 12.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 127.686 2.394 . . . . 0.0 111.565 174.985 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.6 t -55.57 -62.11 1.9 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.73 1.212 . . . . 0.0 112.858 176.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 50.4 ttt180 -54.75 -49.38 70.97 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.495 0.718 . . . . 0.0 110.76 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -58.13 -47.23 83.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.444 1.098 . . . . 0.0 112.426 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -57.15 -43.13 82.19 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 175.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.41 -43.51 75.35 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 118.096 0.407 . . . . 0.0 110.905 175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.1 m -57.73 -38.81 75.94 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.137 0.975 . . . . 0.0 113.432 177.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.6 tp -54.94 -61.06 2.56 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.402 1.081 . . . . 0.0 110.998 177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -66.01 -33.96 76.99 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.794 0.838 . . . . 0.0 112.174 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.9 m-70 -56.89 -60.65 3.27 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 118.401 -0.809 . . . . 0.0 111.831 173.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -55.86 -35.25 66.24 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 119.354 0.979 . . . . 0.0 111.984 178.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.72 -32.3 19.08 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.788 0.835 . . . . 0.0 112.447 177.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -49.69 -32.98 14.53 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.945 0.898 . . . . 0.0 113.11 175.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 tp -62.41 -37.28 85.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.039 0.936 . . . . 0.0 112.081 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.76 -4.99 9.24 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 124.835 1.254 . . . . 0.0 111.648 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 p -130.49 78.82 1.87 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.155 1.382 . . . . 0.0 112.014 -173.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 68.9 mtp180 -124.73 88.6 2.92 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 120.905 -1.122 . . . . 0.0 111.977 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.12 27.81 7.44 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.017 1.327 . . . . 0.0 112.987 -177.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -111.35 63.03 0.61 Allowed 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.413 1.485 . . . . 0.0 111.074 -174.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -142.83 104.5 4.35 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 122.07 0.938 . . . . 0.0 111.252 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.58 0 O-C-N 120.321 -1.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.6 p90 . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 119.199 -0.429 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.92 -10.81 21.52 Favored 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 121.852 1.701 . . . . 0.0 110.751 -174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.99 83.13 0.95 Allowed 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.304 1.042 . . . . 0.0 110.163 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -59.78 154.42 47.37 Favored Pre-proline 0 CA--C 1.548 0.879 0 O-C-N 121.194 -0.941 . . . . 0.0 111.525 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -71.35 128.87 15.12 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 124.087 3.191 . . . . 0.0 108.417 -178.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -67.94 160.83 27.78 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 118.909 -1.116 . . . . 0.0 111.876 176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.24 142.94 66.26 Favored Pre-proline 0 N--CA 1.466 0.343 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.414 ' HG3' HD13 ' A' ' 17' ' ' LEU . 90.5 Cg_endo -72.36 169.19 22.27 Favored 'Trans proline' 0 N--CA 1.428 -2.333 0 O-C-N 123.273 1.143 . . . . 0.0 109.991 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -61.3 134.98 48.24 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 172.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -59.13 -25.03 63.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.57 -0.959 . . . . 0.0 111.925 171.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.7 p30 -100.83 15.33 28.78 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.02 1.328 . . . . 0.0 112.846 174.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.64 149.6 36.5 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.61 1.564 . . . . 0.0 112.531 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 17.1 m -63.21 155.69 72.55 Favored Pre-proline 0 N--CA 1.471 0.582 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 173.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -76.88 -33.14 2.98 Favored 'Trans proline' 0 N--CA 1.44 -1.635 0 C-N-CA 121.849 1.7 . . . . 0.0 111.725 -163.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -59.85 -38.25 81.56 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.48 171.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -58.07 -42.83 86.38 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 121.418 -0.802 . . . . 0.0 111.382 176.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -51.84 -40.45 60.54 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 125.745 1.618 . . . . 0.0 111.309 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.6 t -57.36 -56.41 22.21 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.63 1.572 . . . . 0.0 113.234 177.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -53.84 -40.35 66.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.929 0.892 . . . . 0.0 111.035 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -65.54 -53.74 37.94 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.696 1.199 . . . . 0.0 111.279 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -52.18 -54.25 33.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.036 0.934 . . . . 0.0 112.452 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.47 71.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.098 0.559 . . . . 0.0 111.861 175.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.4 t -65.15 -34.22 77.86 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.493 0.923 . . . . 0.0 113.493 178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.86 -58.96 5.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.244 1.018 . . . . 0.0 111.015 176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -57.71 -37.92 74.33 Favored 'General case' 0 C--N 1.343 0.321 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.14 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -54.16 -48.76 70.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.211 1.004 . . . . 0.0 112.814 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -62.91 -54.33 40.31 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.834 0.454 . . . . 0.0 111.42 175.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 17.3 tp -55.39 -34.01 63.98 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.02 0.528 . . . . 0.0 111.36 178.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -63.98 -33.24 75.28 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.172 0.989 . . . . 0.0 113.107 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 tt -55.26 -29.49 58.19 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.832 0.742 . . . . 0.0 111.936 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.1 p -113.26 15.84 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 125.707 1.603 . . . . 0.0 113.246 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.88 -3.59 55.83 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 120.927 -1.108 . . . . 0.0 113.333 178.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -81.09 52.63 1.82 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.771 1.629 . . . . 0.0 112.247 -173.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 tp60 -119.52 163.46 17.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.801 1.24 . . . . 0.0 111.657 -177.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.13 57.79 1.5 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.674 1.589 . . . . 0.0 111.503 -178.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -83.59 -32.41 25.78 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.414 176.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 119.404 -2.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.6 p90 . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 119.396 -0.335 . . . . 0.0 111.744 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -79.05 -15.14 13.15 Favored 'Trans proline' 0 N--CA 1.439 -1.704 0 C-N-CA 122.286 1.991 . . . . 0.0 110.163 -171.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.09 18.83 8.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.362 2.265 . . . . 0.0 113.908 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -137.06 140.86 32.59 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 127.833 2.453 . . . . 0.0 108.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.59 144.9 56.46 Favored 'Trans proline' 0 N--CA 1.452 -0.936 0 C-N-CA 124.514 3.476 . . . . 0.0 108.783 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.27 160.79 31.35 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 119.288 -0.965 . . . . 0.0 111.001 177.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.77 143.24 51.27 Favored Pre-proline 0 N--CA 1.467 0.393 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HG3' HD13 ' A' ' 17' ' ' LEU . 92.4 Cg_endo -71.54 169.31 21.27 Favored 'Trans proline' 0 N--CA 1.428 -2.357 0 O-C-N 123.168 1.088 . . . . 0.0 110.181 -171.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -58.79 135.32 52.05 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 111.227 -0.749 . . . . 0.0 111.227 170.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.86 -26.84 66.16 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.682 -0.893 . . . . 0.0 112.123 174.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -99.39 16.15 24.03 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 128.068 2.547 . . . . 0.0 113.361 173.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.41 150.86 36.7 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.012 1.325 . . . . 0.0 112.578 176.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.75 152.33 93.18 Favored Pre-proline 0 N--CA 1.471 0.58 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 177.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -72.6 -31.07 11.3 Favored 'Trans proline' 0 N--CA 1.439 -1.697 0 C-N-CA 121.234 1.289 . . . . 0.0 112.72 -163.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -64.33 -33.18 75.24 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.525 0.73 . . . . 0.0 111.782 173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.145 0.978 . . . . 0.0 110.752 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.436 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.8 mm? -52.03 -49.25 63.78 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.946 1.698 . . . . 0.0 111.105 176.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.8 m -56.34 -50.83 70.36 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.618 1.167 . . . . 0.0 113.715 175.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 56.0 ttt85 -53.01 -53.9 43.28 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.476 0.71 . . . . 0.0 110.557 176.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -52.51 -51.62 58.61 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.168 0.987 . . . . 0.0 112.644 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -54.25 -48.34 71.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.33 0.652 . . . . 0.0 112.607 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.25 -43.81 92.4 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.163 0.585 . . . . 0.0 111.745 176.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 m -60.9 -36.42 79.2 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.926 0.891 . . . . 0.0 113.181 176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.5 -54.52 42.88 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.76 0.824 . . . . 0.0 110.891 177.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -37.45 83.91 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-O 118.593 -0.717 . . . . 0.0 111.35 177.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -54.15 -50.54 66.72 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.549 1.14 . . . . 0.0 112.706 178.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -58.38 -57.51 12.59 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 119.021 -0.514 . . . . 0.0 110.991 174.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -53.0 -41.2 64.41 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.629 0.772 . . . . 0.0 111.399 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -59.95 -37.72 80.37 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.738 1.215 . . . . 0.0 113.045 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.96 -24.68 66.08 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.583 -0.698 . . . . 0.0 112.235 174.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.9 t -78.98 26.44 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 125.768 1.627 . . . . 0.0 112.447 178.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 t -165.62 114.89 1.01 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.249 -1.532 . . . . 0.0 111.316 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -132.14 64.74 1.59 Allowed 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.006 1.322 . . . . 0.0 110.652 177.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -64.14 161.33 16.49 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 122.18 0.991 . . . . 0.0 112.285 172.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -83.16 79.28 9.43 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.537 1.135 . . . . 0.0 111.985 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -80.52 103.62 10.5 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.693 1.235 . . . . 0.0 112.052 177.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.613 0 O-C-N 119.867 -1.771 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 119.048 -0.501 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -76.87 -17.05 15.87 Favored 'Trans proline' 0 N--CA 1.444 -1.384 0 C-N-CA 123.251 2.634 . . . . 0.0 110.35 -170.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.43 24.55 11.97 Favored 'General case' 0 N--CA 1.439 -1.023 0 C-N-CA 127.585 2.354 . . . . 0.0 112.601 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.601 ' HE3' HD13 ' A' ' 24' ' ' LEU . 17.4 tttt -158.65 144.71 12.42 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.26 1.824 . . . . 0.0 108.633 -175.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.24 137.7 34.65 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 C-N-CA 124.859 3.706 . . . . 0.0 108.844 176.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -65.65 146.57 54.64 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.991 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.29 137.14 91.75 Favored Pre-proline 0 C--O 1.236 0.363 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -75.54 166.89 27.65 Favored 'Trans proline' 0 N--CA 1.423 -2.625 0 N-CA-C 108.835 -1.256 . . . . 0.0 108.835 -173.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 151.79 29.36 0.04 OUTLIER Glycine 0 CA--C 1.527 0.84 0 CA-C-O 119.273 -0.737 . . . . 0.0 113.645 -174.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -117.24 44.62 2.06 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.238 1.815 . . . . 0.0 109.566 -179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 64.56 30.54 12.75 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.059 0.944 . . . . 0.0 112.034 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -67.14 143.13 56.78 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 128.109 2.564 . . . . 0.0 111.376 177.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -64.18 154.55 82.37 Favored Pre-proline 0 N--CA 1.472 0.67 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 171.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -77.46 -31.8 3.26 Favored 'Trans proline' 0 N--CA 1.441 -1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.959 -160.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.67 -38.45 84.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.756 0.822 . . . . 0.0 110.845 172.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -63.34 -41.1 98.85 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.378 1.071 . . . . 0.0 111.25 177.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -50.78 -50.39 56.08 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.262 1.825 . . . . 0.0 111.153 175.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.9 t -57.1 -43.29 82.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.401 1.08 . . . . 0.0 113.216 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -57.13 -50.3 73.22 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 124.254 1.022 . . . . 0.0 111.219 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -53.34 -52.97 57.5 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.238 1.015 . . . . 0.0 111.432 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -54.43 -51.8 63.78 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 124.475 1.11 . . . . 0.0 113.117 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.14 -44.01 78.79 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 122.542 0.337 . . . . 0.0 111.201 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.5 t -61.85 -41.92 98.41 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.833 1.253 . . . . 0.0 113.345 179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.601 HD13 ' HE3' ' A' ' 4' ' ' LYS . 10.3 tp -54.04 -61.22 2.44 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.681 0.792 . . . . 0.0 111.037 177.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -35.41 72.89 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 118.483 -0.77 . . . . 0.0 110.997 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -54.27 -52.05 62.63 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.144 0.978 . . . . 0.0 112.991 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.17 -47.04 87.62 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.848 0.294 . . . . 0.0 111.159 174.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 31.3 tp -56.37 -40.19 74.14 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 118.981 -0.533 . . . . 0.0 111.856 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -54.07 -34.23 59.54 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.375 0.989 . . . . 0.0 113.123 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.1 tp -59.0 -22.3 60.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.603 0.761 . . . . 0.0 113.028 176.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.46 18.26 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.417 1.487 . . . . 0.0 112.909 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -85.53 -20.74 29.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.095 -1.003 . . . . 0.0 112.79 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -73.55 71.62 1.36 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.719 1.607 . . . . 0.0 110.728 -174.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -74.59 160.86 30.31 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.799 0.809 . . . . 0.0 112.317 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -64.09 -25.05 67.93 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -61.55 -25.38 67.27 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.669 0.788 . . . . 0.0 112.149 171.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.43 0 O-C-N 118.699 -2.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -76.11 -17.68 16.99 Favored 'Trans proline' 0 N--CA 1.438 -1.789 0 C-N-CA 122.383 2.055 . . . . 0.0 110.155 -171.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.86 24.5 14.58 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 127.505 2.322 . . . . 0.0 113.4 173.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt 64.02 162.59 0.12 Allowed Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 127.811 2.445 . . . . 0.0 113.335 -168.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.04 130.48 19.06 Favored 'Trans proline' 0 N--CA 1.451 -1.011 0 C-N-CA 123.552 2.835 . . . . 0.0 107.498 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -67.47 156.63 36.15 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.414 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -54.9 143.86 49.96 Favored Pre-proline 0 N--CA 1.465 0.313 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.465 ' HG3' HD13 ' A' ' 17' ' ' LEU . 88.6 Cg_endo -73.2 168.52 24.54 Favored 'Trans proline' 0 N--CA 1.425 -2.552 0 O-C-N 122.86 0.926 . . . . 0.0 110.156 -172.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -63.76 136.68 41.41 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 111.324 -0.711 . . . . 0.0 111.324 173.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.86 -24.48 64.27 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.794 -0.827 . . . . 0.0 112.29 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -107.4 22.08 16.52 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 126.726 2.01 . . . . 0.0 111.358 174.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.82 149.33 34.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.495 1.518 . . . . 0.0 111.448 174.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.32 153.02 83.56 Favored Pre-proline 0 N--CA 1.47 0.54 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 175.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -76.16 -34.0 3.17 Favored 'Trans proline' 0 N--CA 1.437 -1.827 0 C-N-CA 121.04 1.16 . . . . 0.0 111.849 -163.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -61.52 -34.03 74.83 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.538 172.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -62.81 -41.1 99.15 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.258 -0.901 . . . . 0.0 111.2 175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 8' ' ' PRO . 2.7 mm? -51.76 -44.31 63.28 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.197 1.799 . . . . 0.0 111.363 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.1 m -54.68 -47.54 73.48 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.215 1.406 . . . . 0.0 112.82 174.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.6 mmm180 -59.27 -50.24 74.76 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.602 1.161 . . . . 0.0 110.253 -179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -54.96 -55.02 35.38 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.031 0.933 . . . . 0.0 112.116 176.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -56.66 -52.32 65.36 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.431 0.692 . . . . 0.0 112.745 -178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.72 -47.29 77.14 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 122.737 0.415 . . . . 0.0 111.688 175.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.5 m -58.5 -36.19 73.39 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 176.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.17 -60.3 3.46 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.928 0.891 . . . . 0.0 110.441 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -63.88 -35.18 79.8 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 122.781 0.432 . . . . 0.0 111.249 177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -56.17 -58.3 8.53 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.387 0.54 . . . . 0.0 111.885 178.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -57.24 -34.86 69.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 118.837 0.744 . . . . 0.0 112.061 175.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 9.0 tp -54.31 -25.32 23.19 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 176.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.401 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER -55.09 -23.94 23.14 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 171.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.406 HD12 ' HD3' ' A' ' 33' ' ' ARG . 5.3 tp -76.31 -31.17 58.03 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.452 1.501 . . . . 0.0 112.496 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 28' ' ' LEU . 9.8 p -82.84 -1.39 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.633 -0.667 . . . . 0.0 112.686 178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.3 t -128.53 21.87 6.01 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.383 1.473 . . . . 0.0 112.24 -172.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' HD3' HD12 ' A' ' 30' ' ' LEU . 9.3 ptm180 -121.32 56.49 1.04 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.23 1.812 . . . . 0.0 112.667 -178.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -125.55 176.17 7.03 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.61 1.564 . . . . 0.0 110.349 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -132.13 99.57 4.76 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.991 1.316 . . . . 0.0 107.884 -176.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -110.54 174.07 6.03 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.556 1.17 . . . . 0.0 111.09 178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.674 0 O-C-N 119.063 -2.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.3 p90 . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -78.54 -21.34 10.16 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 C-N-CA 122.061 1.841 . . . . 0.0 109.28 -170.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 58.77 19.53 7.0 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.264 1.426 . . . . 0.0 112.899 177.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -83.99 136.92 40.76 Favored Pre-proline 0 CA--C 1.535 0.383 0 C-N-CA 125.608 1.563 . . . . 0.0 109.546 -177.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -68.15 142.16 54.86 Favored 'Trans proline' 0 N--CA 1.449 -1.146 0 C-N-CA 123.687 2.925 . . . . 0.0 108.02 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.94 160.95 31.93 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.502 176.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.4 143.45 66.01 Favored Pre-proline 0 C--O 1.238 0.448 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HG3' HD13 ' A' ' 17' ' ' LEU . 71.5 Cg_endo -71.51 169.77 20.13 Favored 'Trans proline' 0 N--CA 1.427 -2.392 0 O-C-N 123.244 1.128 . . . . 0.0 109.814 -171.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -64.08 136.61 40.51 Favored Glycine 0 CA--C 1.532 1.156 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.479 172.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.83 -21.88 57.55 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 121.566 -0.961 . . . . 0.0 113.288 172.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -107.94 20.33 18.89 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 125.438 1.495 . . . . 0.0 111.501 174.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 151.46 39.84 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.532 1.533 . . . . 0.0 111.817 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.7 m -68.51 151.17 97.39 Favored Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 116.088 1.884 . . . . 0.0 116.088 174.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -71.25 -32.05 13.42 Favored 'Trans proline' 0 N--CA 1.442 -1.544 0 C-N-CA 122.896 2.397 . . . . 0.0 112.927 -162.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -62.13 -32.28 72.84 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.193 173.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -64.76 -43.16 94.19 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.294 1.038 . . . . 0.0 111.033 175.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.521 HD13 ' HG3' ' A' ' 8' ' ' PRO . 3.1 mm? -49.97 -46.78 52.8 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.822 1.649 . . . . 0.0 110.671 176.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.3 t -56.33 -54.99 39.01 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.991 1.316 . . . . 0.0 113.269 175.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -54.05 -47.18 71.89 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.358 1.063 . . . . 0.0 111.179 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -58.56 -52.05 67.3 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.016 0.926 . . . . 0.0 112.701 175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -56.23 -49.44 74.12 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.062 -1.024 . . . . 0.0 112.37 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.83 -40.25 83.63 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.1 p -64.85 -31.24 72.38 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.12 -55.15 38.65 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.881 0.872 . . . . 0.0 110.242 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -58.27 -34.19 70.23 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.629 0.772 . . . . 0.0 111.723 175.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -56.32 -46.28 79.94 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -64.64 -49.55 70.59 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.064 0.546 . . . . 0.0 111.59 173.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.8 tp -51.9 -38.14 55.12 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.645 0.378 . . . . 0.0 110.559 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -62.4 -42.64 99.59 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 177.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.6 -41.02 93.89 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 121.668 -0.645 . . . . 0.0 111.383 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.8 m -77.37 5.94 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.6 p -129.23 90.17 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.148 1.379 . . . . 0.0 111.107 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -131.91 44.73 2.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.296 1.438 . . . . 0.0 112.586 -177.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -116.81 174.91 5.83 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.937 1.295 . . . . 0.0 111.503 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -112.58 22.1 14.94 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.321 2.248 . . . . 0.0 112.607 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -73.07 155.96 39.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.516 1.15 . . . . 0.0 112.31 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_